2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide

C15H21N3O3 — CID 103145357

IUPAC2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide
SMILESCc1cc([N+](=O)[O-])c(C)cc1NC(=O)CNC1CCCC1
InChIInChI=1S/C15H21N3O3/c1-10-8-14(18(20)21)11(2)7-13(10)17-15(19)9-16-12-5-3-4-6-12/h7-8,12,16H,3-6,9H2,1-2H3,(H,17,19)
InChIKeyGGSUWZYNUSPWNZ-UHFFFAOYSA-N
MW291.35 g/mol
LogP2.68
Rot. Bonds5

About 2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide

2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide (PubChem CID 103145357) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide.

Molecular Properties

Compound Name2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide
PubChem CID103145357
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide
SMILESCc1cc([N+](=O)[O-])c(C)cc1NC(=O)CNC1CCCC1
InChIInChI=1S/C15H21N3O3/c1-10-8-14(18(20)21)11(2)7-13(10)17-15(19)9-16-12-5-3-4-6-12/h7-8,12,16H,3-6,9H2,1-2H3,(H,17,19)
InChIKeyGGSUWZYNUSPWNZ-UHFFFAOYSA-N
XLogP2.68
TPSA84.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(cyclopropylamino)-N-(2,4-dimethyl-5-nitrophenyl)acetamide
CID 115572270
3-(cyclopropylamino)-N-(2,5-dimethyl-4-nitrophenyl)propanamide
CID 103145444
2-(cyclopentylamino)-N-(2-nitrophenyl)acetamide
CID 54917838
2-(cyclopentylamino)-N-(2,4-dinitrophenyl)acetamide
CID 17066729
N-(5-chloro-2-nitrophenyl)-2-(cyclooctylamino)acetamide
CID 9265553
N-(2,5-dimethyl-4-nitrophenyl)-2-piperidin-4-ylacetamide
CID 103145405
N-cyclooctyl-2-(2,4-dimethyl-5-nitroanilino)acetamide
CID 112768188
3-(cyclopropylamino)-N-(4,5-dimethyl-2-nitrophenyl)propanamide
CID 62098274
N-(2-bromo-4-nitrophenyl)-2-(cyclopentylamino)acetamide
CID 60647189
N-(2-chloro-5-nitrophenyl)-2-(cyclopentylamino)acetamide
CID 60648529
N-(3-cyclopropylcyclohexyl)-2,5-dimethyl-4-nitroaniline
CID 103145183
2-(cyclooctylamino)-N-(2-methoxy-5-nitrophenyl)acetamide
CID 9265449

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide?
The IUPAC name of 2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide (CID 103145357) is 2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide.
What is the SMILES notation for 2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide?
The canonical SMILES for 2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide is Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)CNC1CCCC1.
What is the InChIKey of 2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide?
The InChIKey is GGSUWZYNUSPWNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-10-8-14(18(20)21)11(2)7-13(10)17-15(19)9-16-12-5-3-4-6-12/h7-8,12,16H,3-6,9H2,1-2H3,(H,17,19).
What are the key properties of 2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide?
2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide has a molecular weight of 291.35 g/mol, XLogP of 2.68, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylamino)-N-(2,5-dimethyl-4-nitrophenyl)acetamide is sourced from PubChem (CID 103145357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).