N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide

C19H21NO2 — CID 111102549

IUPACN-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide
SMILESO=C(NCC(O)Cc1ccccc1)C1CC1c1ccccc1
InChIInChI=1S/C19H21NO2/c21-16(11-14-7-3-1-4-8-14)13-20-19(22)18-12-17(18)15-9-5-2-6-10-15/h1-10,16-18,21H,11-13H2,(H,20,22)
InChIKeyGHCYEISYJSTKPY-UHFFFAOYSA-N
MW295.38 g/mol
LogP2.51
Rot. Bonds6

About N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide

N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide (PubChem CID 111102549) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide
PubChem CID111102549
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC NameN-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide
SMILESO=C(NCC(O)Cc1ccccc1)C1CC1c1ccccc1
InChIInChI=1S/C19H21NO2/c21-16(11-14-7-3-1-4-8-14)13-20-19(22)18-12-17(18)15-9-5-2-6-10-15/h1-10,16-18,21H,11-13H2,(H,20,22)
InChIKeyGHCYEISYJSTKPY-UHFFFAOYSA-N
XLogP2.51
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxy-3-phenylpropyl)-2-(5-methylthiophen-2-yl)cyclopropane-1-carboxamide
CID 111102637
N-(3-amino-2-hydroxy-3-oxopropyl)-2-phenylcyclopropane-1-carboxamide
CID 107261035
N-[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]-2-phenylcyclopropane-1-carboxamide
CID 110280040
cis-(1R,2S)-N-[(2S)-2-(dimethylamino)-3-(4-hydroxyphenyl)propyl]-2-phenylcyclopropane-1-carboxamide
CID 139568768
trans-(1R,2R)-N-[(2S)-3-amino-2-[(4-fluorophenyl)methyl]-3-oxopropyl]-2-phenylcyclopropane-1-carboxamide
CID 124735793
4-[(2-hydroxy-3-phenylpropyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120673460
N-(3-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide
CID 111471582
trans-(1S,2S)-N-[(4-chlorophenyl)methyl]-2-phenylcyclopropane-1-carboxamide
CID 887980
N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide
CID 95367778
(2R)-2-benzyl-3-[[(1S,2R)-2-methylcyclopropanecarbonyl]amino]propanoic acid
CID 124692134
N-(2-bromoprop-2-enyl)-2-phenylcyclopropane-1-carboxamide
CID 115594336
N-(2-hydroxy-2-methylpropyl)-2-phenylcyclopropane-1-carboxamide
CID 79039782

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide?
The IUPAC name of N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide (CID 111102549) is N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide is O=C(NCC(O)Cc1ccccc1)C1CC1c1ccccc1.
What is the InChIKey of N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide?
The InChIKey is GHCYEISYJSTKPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c21-16(11-14-7-3-1-4-8-14)13-20-19(22)18-12-17(18)15-9-5-2-6-10-15/h1-10,16-18,21H,11-13H2,(H,20,22).
What are the key properties of N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide?
N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide has a molecular weight of 295.38 g/mol, XLogP of 2.51, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-phenylpropyl)-2-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 111102549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).