N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide

C15H23N3O — CID 43375929

IUPACN-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide
SMILESCc1ccc(NC(=O)CN(C)C2CCCC2)cc1N
InChIInChI=1S/C15H23N3O/c1-11-7-8-12(9-14(11)16)17-15(19)10-18(2)13-5-3-4-6-13/h7-9,13H,3-6,10,16H2,1-2H3,(H,17,19)
InChIKeyQCOMXCRIPGYOKZ-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.39
Rot. Bonds4

About N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide

N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide (PubChem CID 43375929) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide
PubChem CID43375929
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide
SMILESCc1ccc(NC(=O)CN(C)C2CCCC2)cc1N
InChIInChI=1S/C15H23N3O/c1-11-7-8-12(9-14(11)16)17-15(19)10-18(2)13-5-3-4-6-13/h7-9,13H,3-6,10,16H2,1-2H3,(H,17,19)
InChIKeyQCOMXCRIPGYOKZ-UHFFFAOYSA-N
XLogP2.39
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.39
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

N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide
CID 43209699
N-(3-amino-4-methylphenyl)-2-[cyclopropylmethyl(ethyl)amino]acetamide
CID 63954898
N-(3-amino-4-methylphenyl)-2-cyclopentylsulfinylacetamide
CID 63115433
2-[acetyl(cyclohexyl)amino]-N-(3,4-dimethylphenyl)acetamide
CID 113159503
2-[cyclohexyl(methyl)amino]-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)acetamide
CID 18078412
N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide
CID 63983055
2-amino-N-(3-amino-4-methylphenyl)acetamide
CID 146654157
N-(3-chloro-4-methylphenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607404
N-(3-amino-4-chlorophenyl)-2-[methyl-(1-methylpiperidin-3-yl)amino]acetamide
CID 62547619
2-[cycloheptyl(methyl)amino]-N-phenylacetamide
CID 16577724
N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide
CID 16782283
N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide
CID 43540705

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide?
The IUPAC name of N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide (CID 43375929) is N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide.
What is the SMILES notation for N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide?
The canonical SMILES for N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide is Cc1ccc(NC(=O)CN(C)C2CCCC2)cc1N.
What is the InChIKey of N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide?
The InChIKey is QCOMXCRIPGYOKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-7-8-12(9-14(11)16)17-15(19)10-18(2)13-5-3-4-6-13/h7-9,13H,3-6,10,16H2,1-2H3,(H,17,19).
What are the key properties of N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide?
N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide has a molecular weight of 261.37 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide is sourced from PubChem (CID 43375929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).