N-(3-methylcyclopentyl)dodecanamide

C18H35NO — CID 114549665

IUPACN-(3-methylcyclopentyl)dodecanamide
SMILESCCCCCCCCCCCC(=O)NC1CCC(C)C1
InChIInChI=1S/C18H35NO/c1-3-4-5-6-7-8-9-10-11-12-18(20)19-17-14-13-16(2)15-17/h16-17H,3-15H2,1-2H3,(H,19,20)
InChIKeyPOJOVPNNIKDOHQ-UHFFFAOYSA-N
MW281.48 g/mol
LogP5.21
Rot. Bonds11

About N-(3-methylcyclopentyl)dodecanamide

N-(3-methylcyclopentyl)dodecanamide (PubChem CID 114549665) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is N-(3-methylcyclopentyl)dodecanamide.

Molecular Properties

Compound NameN-(3-methylcyclopentyl)dodecanamide
PubChem CID114549665
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC NameN-(3-methylcyclopentyl)dodecanamide
SMILESCCCCCCCCCCCC(=O)NC1CCC(C)C1
InChIInChI=1S/C18H35NO/c1-3-4-5-6-7-8-9-10-11-12-18(20)19-17-14-13-16(2)15-17/h16-17H,3-15H2,1-2H3,(H,19,20)
InChIKeyPOJOVPNNIKDOHQ-UHFFFAOYSA-N
XLogP5.21
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.48
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

cis-(1R,3S)-3-(hexanoylamino)cyclopentane-1-carboxylic acid
CID 106320393
3-(hexanoylamino)cyclopentane-1-carboxylic acid
CID 66030150
N-(4-hydroxycyclohexyl)dodecanamide
CID 61380713
N-cyclobutylhexadecanamide
CID 67041463
N-cyclobutylicosanamide
CID 10384249
N-(2-methylpiperidin-4-yl)hexanamide
CID 106995560
N-cyclohexyltetradecanamide
CID 10244853
N-cycloheptylnonanamide
CID 5045141
7-amino-N-(3-methylcyclohexyl)heptanamide
CID 43317968
N,N'-dicyclopropyldecanediamide
CID 4668836
N-[(3S)-pyrrolidin-3-yl]decanamide
CID 79688087
N-(4-oxocyclohexyl)octanamide
CID 43652747

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclopentyl)dodecanamide?
The IUPAC name of N-(3-methylcyclopentyl)dodecanamide (CID 114549665) is N-(3-methylcyclopentyl)dodecanamide.
What is the SMILES notation for N-(3-methylcyclopentyl)dodecanamide?
The canonical SMILES for N-(3-methylcyclopentyl)dodecanamide is CCCCCCCCCCCC(=O)NC1CCC(C)C1.
What is the InChIKey of N-(3-methylcyclopentyl)dodecanamide?
The InChIKey is POJOVPNNIKDOHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-3-4-5-6-7-8-9-10-11-12-18(20)19-17-14-13-16(2)15-17/h16-17H,3-15H2,1-2H3,(H,19,20).
What are the key properties of N-(3-methylcyclopentyl)dodecanamide?
N-(3-methylcyclopentyl)dodecanamide has a molecular weight of 281.48 g/mol, XLogP of 5.21, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclopentyl)dodecanamide is sourced from PubChem (CID 114549665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).