N-(4-methylpentyl)piperidine-3-carboxamide

C12H24N2O — CID 61043776

IUPACN-(4-methylpentyl)piperidine-3-carboxamide
SMILESCC(C)CCCNC(=O)C1CCCNC1
InChIInChI=1S/C12H24N2O/c1-10(2)5-3-8-14-12(15)11-6-4-7-13-9-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyMRJZICVZWLURFA-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.54
Rot. Bonds5

About N-(4-methylpentyl)piperidine-3-carboxamide

N-(4-methylpentyl)piperidine-3-carboxamide (PubChem CID 61043776) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-(4-methylpentyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methylpentyl)piperidine-3-carboxamide
PubChem CID61043776
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-(4-methylpentyl)piperidine-3-carboxamide
SMILESCC(C)CCCNC(=O)C1CCCNC1
InChIInChI=1S/C12H24N2O/c1-10(2)5-3-8-14-12(15)11-6-4-7-13-9-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyMRJZICVZWLURFA-UHFFFAOYSA-N
XLogP1.54
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-5-(piperidine-3-carbonylamino)pentanoic acid
CID 112547799
N-(6-methylheptan-2-yl)piperidine-3-carboxamide;hydrochloride
CID 119262989
(3S)-N-(3-methylsulfonylpropyl)piperidine-3-carboxamide
CID 81128243
(3S)-N-(4-methoxybutyl)piperidine-3-carboxamide
CID 81139140
N-(3-methylsulfanylpropyl)piperidine-3-carboxamide;hydrochloride
CID 119280390
(3R)-N-(3-butoxypropyl)piperidine-3-carboxamide
CID 113481104
(3R)-N-(5,5,5-trifluoropentyl)piperidine-3-carboxamide
CID 113327524
N-(3-cyclohexylpropyl)piperidine-3-carboxamide
CID 119289859
(3S)-N-hex-5-ynylpiperidine-3-carboxamide
CID 106213073
methyl 6-(piperidine-3-carbonylamino)hexanoate
CID 119269488
N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852
N-[3-(4-propan-2-ylphenyl)propyl]piperidine-3-carboxamide
CID 119322605

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpentyl)piperidine-3-carboxamide?
The IUPAC name of N-(4-methylpentyl)piperidine-3-carboxamide (CID 61043776) is N-(4-methylpentyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(4-methylpentyl)piperidine-3-carboxamide?
The canonical SMILES for N-(4-methylpentyl)piperidine-3-carboxamide is CC(C)CCCNC(=O)C1CCCNC1.
What is the InChIKey of N-(4-methylpentyl)piperidine-3-carboxamide?
The InChIKey is MRJZICVZWLURFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10(2)5-3-8-14-12(15)11-6-4-7-13-9-11/h10-11,13H,3-9H2,1-2H3,(H,14,15).
What are the key properties of N-(4-methylpentyl)piperidine-3-carboxamide?
N-(4-methylpentyl)piperidine-3-carboxamide has a molecular weight of 212.34 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpentyl)piperidine-3-carboxamide is sourced from PubChem (CID 61043776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).