N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide

C15H28N2O3 — CID 111461149

IUPACN-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide
SMILESCCC(=O)N1CCCCC1C(=O)NCCC(O)C(C)C
InChIInChI=1S/C15H28N2O3/c1-4-14(19)17-10-6-5-7-12(17)15(20)16-9-8-13(18)11(2)3/h11-13,18H,4-10H2,1-3H3,(H,16,20)
InChIKeyFQFGMQKLSGRAQS-UHFFFAOYSA-N
MW284.40 g/mol
LogP1.30
Rot. Bonds6

About N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide

N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide (PubChem CID 111461149) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide
PubChem CID111461149
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC NameN-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide
SMILESCCC(=O)N1CCCCC1C(=O)NCCC(O)C(C)C
InChIInChI=1S/C15H28N2O3/c1-4-14(19)17-10-6-5-7-12(17)15(20)16-9-8-13(18)11(2)3/h11-13,18H,4-10H2,1-3H3,(H,16,20)
InChIKeyFQFGMQKLSGRAQS-UHFFFAOYSA-N
XLogP1.30
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzoyl-N-(3-hydroxy-4-methylpentyl)piperidine-2-carboxamide
CID 111461020
N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide
CID 111426381
N-(4-hydroxy-2,2-dimethylpentyl)-1-propanoylpiperidine-2-carboxamide
CID 111480417
4-[[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]amino]-2-methylbutanoic acid
CID 80539316
N-(3-hydroxy-4-methylpentyl)bicyclo[4.1.0]heptane-7-carboxamide
CID 111540255
4-[2-[(1-propanoylpiperidine-2-carbonyl)amino]ethyl]benzoic acid
CID 119168696
N-[2-(furan-2-yl)-2-hydroxyethyl]-1-propanoylpiperidine-2-carboxamide
CID 110906621
1-propanoylpiperidine-2-carboxamide
CID 60717244
(2S)-1-[3-(cyclopentanecarbonylamino)propanoyl]-N-methylpiperidine-2-carboxamide
CID 32599029
N-[3-[(3-hydroxy-4-methylpentyl)amino]-3-oxopropyl]cyclohexanecarboxamide
CID 111461401
N-(3-hydroxy-4-methylpentyl)-1-(2-methylbutanoyl)piperidine-3-carboxamide
CID 111460809
N-ethyl-1-(3-methylbutanoyl)pyrrolidine-2-carboxamide
CID 170386383

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide?
The IUPAC name of N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide (CID 111461149) is N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide.
What is the SMILES notation for N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide?
The canonical SMILES for N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide is CCC(=O)N1CCCCC1C(=O)NCCC(O)C(C)C.
What is the InChIKey of N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide?
The InChIKey is FQFGMQKLSGRAQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-4-14(19)17-10-6-5-7-12(17)15(20)16-9-8-13(18)11(2)3/h11-13,18H,4-10H2,1-3H3,(H,16,20).
What are the key properties of N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide?
N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide has a molecular weight of 284.40 g/mol, XLogP of 1.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide is sourced from PubChem (CID 111461149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).