1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol

C13H17NO — CID 117116735

IUPAC1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol
SMILESOC1(c2ccc(C3CCCN3)cc2)CC1
InChIInChI=1S/C13H17NO/c15-13(7-8-13)11-5-3-10(4-6-11)12-2-1-9-14-12/h3-6,12,14-15H,1-2,7-9H2
InChIKeyDZNRZWGPYYJNFP-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.09
Rot. Bonds2

About 1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol

1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol (PubChem CID 117116735) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is 1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol
PubChem CID117116735
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol
SMILESOC1(c2ccc(C3CCCN3)cc2)CC1
InChIInChI=1S/C13H17NO/c15-13(7-8-13)11-5-3-10(4-6-11)12-2-1-9-14-12/h3-6,12,14-15H,1-2,7-9H2
InChIKeyDZNRZWGPYYJNFP-UHFFFAOYSA-N
XLogP2.09
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[1-(methoxymethyl)cyclopropyl]phenyl]pyrrolidine
CID 117116766
(2S)-2-(4-chlorophenyl)pyrrolidine
CID 7009380
(2R)-2-(4-methylphenyl)pyrrolidine
CID 7047871
2-(4-pyrrolidin-3-ylphenyl)pyrrolidine
CID 116988431
4-piperidin-2-ylphenol
CID 19711202
2-(4-chlorophenyl)pyrrolidine;ethane
CID 177172941
(2R)-2-[4-(4-methylphenyl)phenyl]pyrrolidine
CID 66519668
4-[(2S)-pyrrolidin-2-yl]benzene-1,2-diol
CID 66518287
4-[(2R)-pyrrolidin-2-yl]pyridine;hydrochloride
CID 171195835
(2S)-2-(4-bromophenyl)piperidine
CID 7022866
(2S)-2-phenylpiperidine
CID 10997356
(2R)-2-(4-chlorophenyl)piperidine;hydrochloride
CID 155903197

Frequently Asked Questions

What is the IUPAC name of 1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol?
The IUPAC name of 1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol (CID 117116735) is 1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol.
What is the SMILES notation for 1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol?
The canonical SMILES for 1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol is OC1(c2ccc(C3CCCN3)cc2)CC1.
What is the InChIKey of 1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol?
The InChIKey is DZNRZWGPYYJNFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c15-13(7-8-13)11-5-3-10(4-6-11)12-2-1-9-14-12/h3-6,12,14-15H,1-2,7-9H2.
What are the key properties of 1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol?
1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol has a molecular weight of 203.28 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-pyrrolidin-2-ylphenyl)cyclopropan-1-ol is sourced from PubChem (CID 117116735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).