N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide

C11H22N2O2 — CID 79160258

IUPACN-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide
SMILESCC(O)CCNC(=O)N1CCC(C)CC1
InChIInChI=1S/C11H22N2O2/c1-9-4-7-13(8-5-9)11(15)12-6-3-10(2)14/h9-10,14H,3-8H2,1-2H3,(H,12,15)
InChIKeyDYHVFWQFNKDBIG-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.20
Rot. Bonds3

About N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide

N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide (PubChem CID 79160258) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide
PubChem CID79160258
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide
SMILESCC(O)CCNC(=O)N1CCC(C)CC1
InChIInChI=1S/C11H22N2O2/c1-9-4-7-13(8-5-9)11(15)12-6-3-10(2)14/h9-10,14H,3-8H2,1-2H3,(H,12,15)
InChIKeyDYHVFWQFNKDBIG-UHFFFAOYSA-N
XLogP1.20
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-(3-methylbutyl)piperidine-1-carboxamide
CID 51712124
N-[(3R)-3-fluorobutyl]-4-methylpiperidine-1-carboxamide
CID 129348452
(2S)-2-hydroxy-4-[(4-methylpiperidine-1-carbonyl)amino]butanoic acid
CID 107835108
4-methyl-N-propylpiperidine-1-carboxamide
CID 19169940
2-methyl-5-[(4-methylpiperidine-1-carbonyl)amino]pentanoic acid
CID 113440701
N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpiperidine-1-carboxamide
CID 115583128
4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide
CID 104578083
4-(1-hydroxyethyl)-N-(3-methylbutyl)piperidine-1-carboxamide
CID 111437840
N-(4-hydroxy-2,2-dimethylpentyl)-4-methylpiperidine-1-carboxamide
CID 111507377
propan-2-yl 3-[(4-methylpiperidine-1-carbonyl)amino]propanoate
CID 52539083
N-(3-cyanopropyl)-4-methylpiperidine-1-carboxamide
CID 79160318
N-[2-(methanesulfinamido)ethyl]-4-methylpiperidine-1-carboxamide
CID 143816836

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide?
The IUPAC name of N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide (CID 79160258) is N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide?
The canonical SMILES for N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide is CC(O)CCNC(=O)N1CCC(C)CC1.
What is the InChIKey of N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide?
The InChIKey is DYHVFWQFNKDBIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9-4-7-13(8-5-9)11(15)12-6-3-10(2)14/h9-10,14H,3-8H2,1-2H3,(H,12,15).
What are the key properties of N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide?
N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 1.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide is sourced from PubChem (CID 79160258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).