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

C15H23N3O — CID 43266827

IUPACN-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide
SMILESCc1c(N)cccc1NC(=O)CN(C)C1CCCC1
InChIInChI=1S/C15H23N3O/c1-11-13(16)8-5-9-14(11)17-15(19)10-18(2)12-6-3-4-7-12/h5,8-9,12H,3-4,6-7,10,16H2,1-2H3,(H,17,19)
InChIKeyAPUSBLUFZQLIDE-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.39
Rot. Bonds4

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

N-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide (PubChem CID 43266827) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide
PubChem CID43266827
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide
SMILESCc1c(N)cccc1NC(=O)CN(C)C1CCCC1
InChIInChI=1S/C15H23N3O/c1-11-13(16)8-5-9-14(11)17-15(19)10-18(2)12-6-3-4-7-12/h5,8-9,12H,3-4,6-7,10,16H2,1-2H3,(H,17,19)
InChIKeyAPUSBLUFZQLIDE-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-2-methylphenyl)-2-[methyl-(1-methylpiperidin-3-yl)amino]acetamide
CID 62545494
N-(3-amino-2-methylphenyl)-3-[cyclopentyl(ethyl)amino]propanamide
CID 43540741
2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide
CID 16577693
N-(3-amino-2-methylphenyl)-2-cyclopentylsulfanylacetamide
CID 55136606
N-(2-aminophenyl)-2-[(4-ethylcyclohexyl)-methylamino]acetamide
CID 61450802
2-[cyclopentyl(methyl)amino]-N-[(2,3-dimethylphenyl)carbamoyl]acetamide
CID 51282081
3-N-[2-[cyclopentyl(methyl)amino]ethyl]-2-methylbenzene-1,3-diamine
CID 63314499
N-(3-amino-2-methylphenyl)-2-[methyl(2,2,2-trifluoroethyl)amino]acetamide
CID 60890964
N-(3-amino-2-methylphenyl)-3-(dimethylamino)propanamide
CID 16792974
N-(3-amino-2-methylphenyl)-3-[cyclopropyl(ethyl)amino]propanamide
CID 43263763
N-(3-amino-2-methylphenyl)-2-(3-methylcyclohexyl)oxyacetamide
CID 43127290
N-(2,3-dimethylphenyl)-2-[(2-hydroxycyclohexyl)-methylamino]acetamide
CID 110883640

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide?
The IUPAC name of N-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide (CID 43266827) is N-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide.
What is the SMILES notation for N-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide?
The canonical SMILES for N-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide is Cc1c(N)cccc1NC(=O)CN(C)C1CCCC1.
What is the InChIKey of N-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide?
The InChIKey is APUSBLUFZQLIDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-13(16)8-5-9-14(11)17-15(19)10-18(2)12-6-3-4-7-12/h5,8-9,12H,3-4,6-7,10,16H2,1-2H3,(H,17,19).
What are the key properties of N-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide?
N-(3-amino-2-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-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide is sourced from PubChem (CID 43266827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).