2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide

C19H30N2O2 — CID 119747072

IUPAC2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide
SMILESCCC(C)C(N)C(=O)NCC1(c2ccccc2OC)CCCC1
InChIInChI=1S/C19H30N2O2/c1-4-14(2)17(20)18(22)21-13-19(11-7-8-12-19)15-9-5-6-10-16(15)23-3/h5-6,9-10,14,17H,4,7-8,11-13,20H2,1-3H3,(H,21,22)
InChIKeySPIXEZUMGWEIOC-UHFFFAOYSA-N
MW318.46 g/mol
LogP3.00
Rot. Bonds7

About 2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide

2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide (PubChem CID 119747072) has the molecular formula C19H30N2O2 and a molecular weight of 318.46 g/mol. Its IUPAC name is 2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide
PubChem CID119747072
Molecular FormulaC19H30N2O2
Molecular Weight318.46 g/mol
Exact Mass318.23
IUPAC Name2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide
SMILESCCC(C)C(N)C(=O)NCC1(c2ccccc2OC)CCCC1
InChIInChI=1S/C19H30N2O2/c1-4-14(2)17(20)18(22)21-13-19(11-7-8-12-19)15-9-5-6-10-16(15)23-3/h5-6,9-10,14,17H,4,7-8,11-13,20H2,1-3H3,(H,21,22)
InChIKeySPIXEZUMGWEIOC-UHFFFAOYSA-N
XLogP3.00
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]carbamate
CID 110477745
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide
CID 110441312
1,1-diethyl-3-[[1-(2-methoxyphenyl)cyclopentyl]methyl]urea
CID 110445118
2-(2-methoxyphenyl)-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]acetamide
CID 110446469
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]-2-oxopropanamide
CID 110478355
1-[[1-(2-methoxyphenyl)cyclobutyl]methyl]-3-phenylurea
CID 110446753
1-[[1-(2-methoxyphenyl)cyclopropyl]methyl]-3-(2-methylpropyl)urea
CID 60612371
1-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-[1-(1H-1,2,4-triazol-5-yl)ethyl]urea
CID 75518109
2-(4-aminophenyl)-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]acetamide;hydrochloride
CID 119747038
2-amino-N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]-2-(oxan-4-yl)acetamide
CID 120791308
N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]pyridine-4-carboxamide
CID 110444850
2-amino-N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120791307

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide?
The IUPAC name of 2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide (CID 119747072) is 2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide.
What is the SMILES notation for 2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide?
The canonical SMILES for 2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide is CCC(C)C(N)C(=O)NCC1(c2ccccc2OC)CCCC1.
What is the InChIKey of 2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide?
The InChIKey is SPIXEZUMGWEIOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2/c1-4-14(2)17(20)18(22)21-13-19(11-7-8-12-19)15-9-5-6-10-16(15)23-3/h5-6,9-10,14,17H,4,7-8,11-13,20H2,1-3H3,(H,21,22).
What are the key properties of 2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide?
2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide has a molecular weight of 318.46 g/mol, XLogP of 3.00, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide is sourced from PubChem (CID 119747072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).