N-cyclopentyl-3-(2,6-diethylanilino)propanamide

C18H28N2O — CID 109013502

IUPACN-cyclopentyl-3-(2,6-diethylanilino)propanamide
SMILESCCc1cccc(CC)c1NCCC(=O)NC1CCCC1
InChIInChI=1S/C18H28N2O/c1-3-14-8-7-9-15(4-2)18(14)19-13-12-17(21)20-16-10-5-6-11-16/h7-9,16,19H,3-6,10-13H2,1-2H3,(H,20,21)
InChIKeyQNHHWLVJAMIUBC-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.67
Rot. Bonds7

About N-cyclopentyl-3-(2,6-diethylanilino)propanamide

N-cyclopentyl-3-(2,6-diethylanilino)propanamide (PubChem CID 109013502) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-cyclopentyl-3-(2,6-diethylanilino)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(2,6-diethylanilino)propanamide
PubChem CID109013502
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-cyclopentyl-3-(2,6-diethylanilino)propanamide
SMILESCCc1cccc(CC)c1NCCC(=O)NC1CCCC1
InChIInChI=1S/C18H28N2O/c1-3-14-8-7-9-15(4-2)18(14)19-13-12-17(21)20-16-10-5-6-11-16/h7-9,16,19H,3-6,10-13H2,1-2H3,(H,20,21)
InChIKeyQNHHWLVJAMIUBC-UHFFFAOYSA-N
XLogP3.67
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-3-(2,6-diethylanilino)propanamide
CID 109014023
N-cyclohexyl-3-(2-ethylanilino)propanamide
CID 109014016
N-cycloheptyl-N'-(2,6-diethylphenyl)propanediamide
CID 108951577
N-cyclopentyl-3-(4-ethylanilino)propanamide
CID 109013496
N-cyclopropyl-3-[2,6-di(propan-2-yl)anilino]propanamide
CID 109011766
2-(cyclopentylamino)-N-(2,6-diethylphenyl)acetamide
CID 60647214
3-(3-acetamidoanilino)-N-cyclohexylpropanamide
CID 109014056
3-(3-acetylanilino)-N-cyclohexylpropanamide
CID 109014054
N-cycloheptyl-2-(2-ethylanilino)acetamide
CID 60631370
6-N-cyclopentyl-2-N-(2,6-diethylphenyl)pyridine-2,6-dicarboxamide
CID 109095028
3-(3-chloroanilino)-N-cycloheptylpropanamide
CID 109031475
N-cyclohexyl-3-[[N-[(2-ethylphenyl)methyl]-N'-methylcarbamimidoyl]amino]propanamide
CID 111635358

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(2,6-diethylanilino)propanamide?
The IUPAC name of N-cyclopentyl-3-(2,6-diethylanilino)propanamide (CID 109013502) is N-cyclopentyl-3-(2,6-diethylanilino)propanamide.
What is the SMILES notation for N-cyclopentyl-3-(2,6-diethylanilino)propanamide?
The canonical SMILES for N-cyclopentyl-3-(2,6-diethylanilino)propanamide is CCc1cccc(CC)c1NCCC(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-3-(2,6-diethylanilino)propanamide?
The InChIKey is QNHHWLVJAMIUBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-3-14-8-7-9-15(4-2)18(14)19-13-12-17(21)20-16-10-5-6-11-16/h7-9,16,19H,3-6,10-13H2,1-2H3,(H,20,21).
What are the key properties of N-cyclopentyl-3-(2,6-diethylanilino)propanamide?
N-cyclopentyl-3-(2,6-diethylanilino)propanamide has a molecular weight of 288.44 g/mol, XLogP of 3.67, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(2,6-diethylanilino)propanamide is sourced from PubChem (CID 109013502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).