N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide

C13H26N2O2 — CID 114423393

IUPACN-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide
SMILESCCCCN(CCO)C(=O)C1CC(C)CCN1
InChIInChI=1S/C13H26N2O2/c1-3-4-7-15(8-9-16)13(17)12-10-11(2)5-6-14-12/h11-12,14,16H,3-10H2,1-2H3
InChIKeyJJERFZBQZRNXKA-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.00
Rot. Bonds6

About N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide

N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide (PubChem CID 114423393) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide
PubChem CID114423393
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide
SMILESCCCCN(CCO)C(=O)C1CC(C)CCN1
InChIInChI=1S/C13H26N2O2/c1-3-4-7-15(8-9-16)13(17)12-10-11(2)5-6-14-12/h11-12,14,16H,3-10H2,1-2H3
InChIKeyJJERFZBQZRNXKA-UHFFFAOYSA-N
XLogP1.00
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dibutyl-4-ethylpiperidine-2-carboxamide
CID 114428005
N-hexyl-N-(2-hydroxyethyl)piperidine-2-carboxamide
CID 54873129
N-hexyl-N-(2-hydroxyethyl)azepane-2-carboxamide
CID 64561900
N,N-bis(2-amino-2-oxoethyl)-4-methylpiperidine-2-carboxamide
CID 114423960
4-methyl-N-propan-2-yl-N-propylpiperidine-2-carboxamide
CID 114422783
(2S)-N,N-dipentylpyrrolidine-2-carboxamide
CID 61165096
N-heptyl-N-(3-hydroxypropyl)-2-methylpyrrolidine-3-carboxamide
CID 79388298
(2R)-N,N-dipentylpiperidine-2-carboxamide
CID 93372342
N-[2-(2-hydroxyethoxy)ethyl]-N,4-dimethylpiperidine-2-carboxamide
CID 114243077
N-ethyl-4-methyl-N-propan-2-ylpiperidine-2-carboxamide
CID 114422779
5-amino-N-butyl-N-(2-hydroxyethyl)-2,4-dimethylcyclohexane-1-carboxamide
CID 102706594
2-amino-N,N-dibutyl-5-methylcyclohexane-1-carboxamide
CID 65456425

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide?
The IUPAC name of N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide (CID 114423393) is N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide?
The canonical SMILES for N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide is CCCCN(CCO)C(=O)C1CC(C)CCN1.
What is the InChIKey of N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide?
The InChIKey is JJERFZBQZRNXKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-3-4-7-15(8-9-16)13(17)12-10-11(2)5-6-14-12/h11-12,14,16H,3-10H2,1-2H3.
What are the key properties of N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide?
N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide has a molecular weight of 242.36 g/mol, XLogP of 1.00, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-(2-hydroxyethyl)-4-methylpiperidine-2-carboxamide is sourced from PubChem (CID 114423393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).