2-(Pyrrolidin-1-yl)phenol

C10H13NOCAS 4787-77-3163.22 g/mol

Open in Covalent MOL file
NHO
PhenolTertiary amine

Properties

Molecular formula
C10H13NO
Molar mass
163.22 g/mol
Exact mass
163.0997 Da
logP
1.99Crippen estimate
Polar surface area
23.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
4787-77-3
SMILES
C1CCN(C1)C2=CC=CC=C2O
InChIKey
ZGSBDRFDXWRZAE-UHFFFAOYSA-N
InChI
InChI=1S/C10H13NO/c12-10-6-2-1-5-9(10)11-7-3-4-8-11/h1-2,5-6,12H,3-4,7-8H2

Weigh it out

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Names and synonyms

1 names
  • 2-(1-Pyrrolidino)phenol

Work with 2-(Pyrrolidin-1-yl)phenol

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

Similar compounds

2-(1-Piperazinyl)phenol1011-17-268 % similar 2-(Piperidin-1-yl)aniline39643-31-750 % similar 2-Piperidin-1-yl-benzonitrile72752-52-447 % similar 2-(Piperidin-1-yl)benzaldehyde34595-26-145 % similar 1-Phenylpyrrolidine4096-21-344 % similar Catechol120-80-943 % similar N-Phenylpiperidine4096-20-243 % similar (1,1'-Biphenyl)-2,2'-diol1806-29-738 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

6-Methoxy-1,2,3,4-tetrahydroquinoline120-15-0 Formetorex15302-18-8 (+)-Methcathinone160977-88-8 1-(4-Aminophenyl)-1-butanone1688-71-7 (S)-1,2,3,4-Tetrahydro-3-isoquinolinemethanol18881-17-9 4-Dimethylaminoacetophenone2124-31-4 N-(2,6-Dimethylphenyl)acetamide2198-53-0 N-(3,4-Dimethylphenyl)acetamide2198-54-1

Elsewhere

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