2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide

C17H27N3O — CID 64685802

IUPAC2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide
SMILESCCN(CC)c1ccc(NC(=O)CC2(N)CCCC2)cc1
InChIInChI=1S/C17H27N3O/c1-3-20(4-2)15-9-7-14(8-10-15)19-16(21)13-17(18)11-5-6-12-17/h7-10H,3-6,11-13,18H2,1-2H3,(H,19,21)
InChIKeyVMXSUDDEKOEOOF-UHFFFAOYSA-N
MW289.42 g/mol
LogP3.13
Rot. Bonds6

About 2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide

2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide (PubChem CID 64685802) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide
PubChem CID64685802
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide
SMILESCCN(CC)c1ccc(NC(=O)CC2(N)CCCC2)cc1
InChIInChI=1S/C17H27N3O/c1-3-20(4-2)15-9-7-14(8-10-15)19-16(21)13-17(18)11-5-6-12-17/h7-10H,3-6,11-13,18H2,1-2H3,(H,19,21)
InChIKeyVMXSUDDEKOEOOF-UHFFFAOYSA-N
XLogP3.13
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-(1-aminocyclobutyl)-N-[4-(dimethylamino)phenyl]acetamide
CID 79851270
2-(1-aminocyclopentyl)-N-(4-tert-butylphenyl)acetamide
CID 64686111
4-[[2-(1-aminocyclopentyl)acetyl]amino]benzoic acid
CID 64678175
2-(1-aminocyclohexyl)-N-(4-propan-2-ylphenyl)acetamide
CID 64684135
N-[4-(diethylamino)phenyl]-2-[1-(sulfanylmethyl)cyclopropyl]acetamide
CID 107029422
methyl N-[4-[[2-(1-aminocyclobutyl)acetyl]amino]phenyl]carbamate
CID 79854067
3-[4-(diethylamino)anilino]-3-oxopropanoic acid
CID 62230045
N-(4-acetamidophenyl)-N'-[4-(diethylamino)phenyl]propanediamide
CID 108956266
2-(1-aminocyclobutyl)-N-[4-(methoxymethyl)phenyl]acetamide
CID 114253141
2-(1-aminocyclopentyl)-N-[4-(difluoromethoxy)phenyl]acetamide
CID 64683969
2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide
CID 109010373
[4-(diethylamino)phenyl]urea;hydrochloride
CID 140506859

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide?
The IUPAC name of 2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide (CID 64685802) is 2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide.
What is the SMILES notation for 2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide?
The canonical SMILES for 2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide is CCN(CC)c1ccc(NC(=O)CC2(N)CCCC2)cc1.
What is the InChIKey of 2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide?
The InChIKey is VMXSUDDEKOEOOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-3-20(4-2)15-9-7-14(8-10-15)19-16(21)13-17(18)11-5-6-12-17/h7-10H,3-6,11-13,18H2,1-2H3,(H,19,21).
What are the key properties of 2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide?
2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide has a molecular weight of 289.42 g/mol, XLogP of 3.13, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-N-[4-(diethylamino)phenyl]acetamide is sourced from PubChem (CID 64685802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).