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

C11H22N2O2 — CID 115734509

IUPACN-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide
SMILESCC(O)CCN(C)C(=O)C1CCCNC1
InChIInChI=1S/C11H22N2O2/c1-9(14)5-7-13(2)11(15)10-4-3-6-12-8-10/h9-10,12,14H,3-8H2,1-2H3
InChIKeyMNOXDIFWTGYVDS-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.22
Rot. Bonds4

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

N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide (PubChem CID 115734509) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide
PubChem CID115734509
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide
SMILESCC(O)CCN(C)C(=O)C1CCCNC1
InChIInChI=1S/C11H22N2O2/c1-9(14)5-7-13(2)11(15)10-4-3-6-12-8-10/h9-10,12,14H,3-8H2,1-2H3
InChIKeyMNOXDIFWTGYVDS-UHFFFAOYSA-N
XLogP0.22
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-N-methyl-N-(3-methylbutyl)piperidine-3-carboxamide
CID 81129333
N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide
CID 50988968
N-methyl-N-(2-propan-2-yloxyethyl)piperidine-3-carboxamide
CID 81055489
N-(3,3-dimethylbutyl)-N-methylpiperidine-3-carboxamide
CID 115159936
(3S)-N-methyl-N-pentylpiperidine-3-carboxamide
CID 81123765
(3S)-N-methyl-N-[3-(methylamino)propyl]piperidine-3-carboxamide
CID 81134967
N-(3-hydroxybutyl)-N-methyl-6-oxopiperidine-3-carboxamide
CID 115691430
(3S)-N,N-dimethylpiperidine-3-carboxamide
CID 11469201
N-(2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide;hydrochloride
CID 119299426
(3S)-N-methyl-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 81124814
N-methyl-N-[2-(oxan-4-yl)ethyl]piperidine-3-carboxamide;hydrochloride
CID 119331855
N-[2-(cyclopropylmethoxy)ethyl]-N-methylpiperidine-3-carboxamide;hydrochloride
CID 119340577

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide?
The IUPAC name of N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide (CID 115734509) is N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide?
The canonical SMILES for N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide is CC(O)CCN(C)C(=O)C1CCCNC1.
What is the InChIKey of N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide?
The InChIKey is MNOXDIFWTGYVDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(14)5-7-13(2)11(15)10-4-3-6-12-8-10/h9-10,12,14H,3-8H2,1-2H3.
What are the key properties of N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide?
N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 115734509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).