(Pyrrolidin-3-yl)methanol

C₅H₁₁NOCAS 5082-74-6101.15 g/mol

Open in Covalent MOL file

Alcohol Secondary amine

Properties

Molecular formula: C₅H₁₁NO
Molar mass: 101.15 g/mol
Exact mass: 101.0841 Da
logP: -0.41Crippen estimate
Polar surface area: 32.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

5082-74-6

SMILES

C1CNCC1CO

InChIKey

QOTUIIJRVXKSJU-UHFFFAOYSA-N

InChI

InChI=1S/C5H11NO/c7-4-5-1-2-6-3-5/h5-7H,1-4H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

3-Hydroxymethylpyrrolidine

Work with (Pyrrolidin-3-yl)methanol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(3S)-3-Pyrrolidinemethanol110013-19-9Defined stereoisomer D-Beta-Prolinol110013-18-8Defined stereoisomer

Similar compounds

(3S)-Piperidin-3-ylmethanol144539-77-573 % similar 3-Piperidinemethanol4606-65-973 % similar 4-Piperidinemethanol6457-49-470 % similar (Azetidin-3-yl)methanol hydrochloride928038-44-252 % similar 4-Piperidineethanol622-26-446 % similar Cyclohexanedimethanol105-08-845 % similar Cyclopropanemethanol2516-33-845 % similar trans-1,4-Cyclohexanedimethanol3236-48-445 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

(S)-(+)-1-Methyl-3-pyrrolidinol104641-59-0 (3R)-1-Methyl-3-pyrrolidinol104641-60-3 (3R)-Tetrahydro-3-furanmethanamine1048962-82-8 (3S)-Tetrahydro-3-furanmethanamine1048962-84-0 N-Methylmorpholine109-02-4 Oxan-3-amine120811-32-7

Elsewhere

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