N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide

C18H26N2O — CID 75537852

IUPACN-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide
SMILESCN(C)C1(CNC(=O)C2CC2c2ccccc2)CCCC1
InChIInChI=1S/C18H26N2O/c1-20(2)18(10-6-7-11-18)13-19-17(21)16-12-15(16)14-8-4-3-5-9-14/h3-5,8-9,15-16H,6-7,10-13H2,1-2H3,(H,19,21)
InChIKeyLNIGAKZKQMKDNP-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.78
Rot. Bonds5

About N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide

N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide (PubChem CID 75537852) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide
PubChem CID75537852
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide
SMILESCN(C)C1(CNC(=O)C2CC2c2ccccc2)CCCC1
InChIInChI=1S/C18H26N2O/c1-20(2)18(10-6-7-11-18)13-19-17(21)16-12-15(16)14-8-4-3-5-9-14/h3-5,8-9,15-16H,6-7,10-13H2,1-2H3,(H,19,21)
InChIKeyLNIGAKZKQMKDNP-UHFFFAOYSA-N
XLogP2.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(hydroxymethyl)cyclopropyl]methyl]-2-phenylcyclopropane-1-carboxamide
CID 80710988
trans-(1S,2S)-N-[(1-aminocyclohexyl)methyl]-2-phenylcyclopropane-1-carboxamide
CID 99776033
N-[[1-(2-chloroethyl)cyclopropyl]methyl]-2-phenylcyclopropane-1-carboxamide
CID 114758096
6-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 83108655
cis-(1S,2R)-N-[2-(dimethylamino)ethyl]-2-phenylcyclopropane-1-carboxamide
CID 40540857
(1S,6R)-6-[[1-(dimethylamino)cyclobutyl]methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 105414269
6-[[1-(dimethylamino)cyclobutyl]methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 105414256
N-[[1-(dimethylamino)cyclohexyl]methyl]-4-methylpyrrolidine-3-carboxamide
CID 55231312
N-(2-hydroxy-2-methylpropyl)-2-phenylcyclopropane-1-carboxamide
CID 79039782
1-[(2-phenylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid
CID 78971312
N-[(1-hydroxycycloheptyl)methyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide
CID 111433093
N-(2-bromoprop-2-enyl)-2-phenylcyclopropane-1-carboxamide
CID 115594336

Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide?
The IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide (CID 75537852) is N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide is CN(C)C1(CNC(=O)C2CC2c2ccccc2)CCCC1.
What is the InChIKey of N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide?
The InChIKey is LNIGAKZKQMKDNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-20(2)18(10-6-7-11-18)13-19-17(21)16-12-15(16)14-8-4-3-5-9-14/h3-5,8-9,15-16H,6-7,10-13H2,1-2H3,(H,19,21).
What are the key properties of N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide?
N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclopentyl]methyl]-2-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 75537852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).