2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide

C15H22N2O2 — CID 115413379

IUPAC2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CCC(C)C2C)c(N)c1
InChIInChI=1S/C15H22N2O2/c1-9-4-7-14(10(9)2)17-15(18)12-6-5-11(19-3)8-13(12)16/h5-6,8-10,14H,4,7,16H2,1-3H3,(H,17,18)
InChIKeyKNNDDNJDEXSGLC-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.44
Rot. Bonds3

About 2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide

2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide (PubChem CID 115413379) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide.

Molecular Properties

Compound Name2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide
PubChem CID115413379
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CCC(C)C2C)c(N)c1
InChIInChI=1S/C15H22N2O2/c1-9-4-7-14(10(9)2)17-15(18)12-6-5-11(19-3)8-13(12)16/h5-6,8-10,14H,4,7,16H2,1-3H3,(H,17,18)
InChIKeyKNNDDNJDEXSGLC-UHFFFAOYSA-N
XLogP2.44
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide
CID 115413150
2-amino-4-methoxy-N-(2-methylcyclopentyl)benzamide
CID 115413242
2-amino-N-[2-(hydroxymethyl)cyclohexyl]-4-methoxybenzamide
CID 106361507
2-amino-N-(3,5-dimethylcyclohexyl)-4-methoxybenzamide
CID 115413365
2-amino-N-hydroxy-4-methoxybenzamide
CID 115413301
2-amino-4-methoxy-N-(oxan-4-yl)benzamide
CID 89025989
2-amino-N-(4-carbamoylcyclohexyl)-4-methoxybenzamide
CID 115412622
4-bromo-N-(2,3-dimethylcyclopentyl)-2-methoxybenzamide
CID 115369291
2-amino-N-(dicyclopropylmethyl)-4-methoxybenzamide
CID 115412967
2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methoxybenzamide
CID 83021113
2,4-dimethoxy-N-[(3R,4S)-3-methylpiperidin-4-yl]benzamide
CID 124516888
2-[(2-amino-5-methoxybenzoyl)amino]cyclohexane-1-carboxylic acid
CID 115413375

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide?
The IUPAC name of 2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide (CID 115413379) is 2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide.
What is the SMILES notation for 2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide?
The canonical SMILES for 2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide is COc1ccc(C(=O)NC2CCC(C)C2C)c(N)c1.
What is the InChIKey of 2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide?
The InChIKey is KNNDDNJDEXSGLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-9-4-7-14(10(9)2)17-15(18)12-6-5-11(19-3)8-13(12)16/h5-6,8-10,14H,4,7,16H2,1-3H3,(H,17,18).
What are the key properties of 2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide?
2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide has a molecular weight of 262.35 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide is sourced from PubChem (CID 115413379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).