1-(benzylamino)-2-methylcyclopentane-1-carboxamide

C14H20N2O — CID 65045227

IUPAC1-(benzylamino)-2-methylcyclopentane-1-carboxamide
SMILESCC1CCCC1(NCc1ccccc1)C(N)=O
InChIInChI=1S/C14H20N2O/c1-11-6-5-9-14(11,13(15)17)16-10-12-7-3-2-4-8-12/h2-4,7-8,11,16H,5-6,9-10H2,1H3,(H2,15,17)
InChIKeyNLQOZSHHVBQRCN-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.82
Rot. Bonds4

About 1-(benzylamino)-2-methylcyclopentane-1-carboxamide

1-(benzylamino)-2-methylcyclopentane-1-carboxamide (PubChem CID 65045227) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 1-(benzylamino)-2-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(benzylamino)-2-methylcyclopentane-1-carboxamide
PubChem CID65045227
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name1-(benzylamino)-2-methylcyclopentane-1-carboxamide
SMILESCC1CCCC1(NCc1ccccc1)C(N)=O
InChIInChI=1S/C14H20N2O/c1-11-6-5-9-14(11,13(15)17)16-10-12-7-3-2-4-8-12/h2-4,7-8,11,16H,5-6,9-10H2,1H3,(H2,15,17)
InChIKeyNLQOZSHHVBQRCN-UHFFFAOYSA-N
XLogP1.82
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(benzylamino)-2-methylcyclopentane-1-carboxylic acid
CID 65045391
1-(benzylamino)-4-methylcycloheptane-1-carboxamide
CID 65084787
1-(benzylcarbamoylamino)-2-methylcyclohexane-1-carboxylic acid
CID 16788652
1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine
CID 65384422
2-methyl-1-(pyridin-3-ylmethylamino)cyclohexane-1-carboxylic acid
CID 114990010
1-(2-chloroanilino)-2-methylcyclopentane-1-carboxamide
CID 65045384
2-methyl-1-(2,2,2-trifluoroethylamino)cyclopentane-1-carboxamide
CID 65044708
1-[2-(dimethylamino)ethylamino]-2-methylcyclopentane-1-carboxamide
CID 65045175
1-(benzylamino)-4-propylcycloheptane-1-carboxamide
CID 65088717
1-(benzylamino)cyclobutane-1,2-dicarboxylic acid
CID 18971293
1-(2-azidoethylamino)-2-methylcyclopentane-1-carboxamide
CID 66189857
[1-(benzylamino)-4-methylcycloheptyl]methanol
CID 65085339

Frequently Asked Questions

What is the IUPAC name of 1-(benzylamino)-2-methylcyclopentane-1-carboxamide?
The IUPAC name of 1-(benzylamino)-2-methylcyclopentane-1-carboxamide (CID 65045227) is 1-(benzylamino)-2-methylcyclopentane-1-carboxamide.
What is the SMILES notation for 1-(benzylamino)-2-methylcyclopentane-1-carboxamide?
The canonical SMILES for 1-(benzylamino)-2-methylcyclopentane-1-carboxamide is CC1CCCC1(NCc1ccccc1)C(N)=O.
What is the InChIKey of 1-(benzylamino)-2-methylcyclopentane-1-carboxamide?
The InChIKey is NLQOZSHHVBQRCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-11-6-5-9-14(11,13(15)17)16-10-12-7-3-2-4-8-12/h2-4,7-8,11,16H,5-6,9-10H2,1H3,(H2,15,17).
What are the key properties of 1-(benzylamino)-2-methylcyclopentane-1-carboxamide?
1-(benzylamino)-2-methylcyclopentane-1-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzylamino)-2-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 65045227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).