(3R)-N-(2-ethylhexyl)piperidine-3-carboxamide

C14H28N2O — CID 81141050

IUPAC(3R)-N-(2-ethylhexyl)piperidine-3-carboxamide
SMILESCCCCC(CC)CNC(=O)[C@@H]1CCCNC1
InChIInChI=1S/C14H28N2O/c1-3-5-7-12(4-2)10-16-14(17)13-8-6-9-15-11-13/h12-13,15H,3-11H2,1-2H3,(H,16,17)/t12?,13-/m1/s1
InChIKeyQERVXLBMOGVFJB-ZGTCLIOFSA-N
MW240.39 g/mol
LogP2.32
Rot. Bonds7

About (3R)-N-(2-ethylhexyl)piperidine-3-carboxamide

(3R)-N-(2-ethylhexyl)piperidine-3-carboxamide (PubChem CID 81141050) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is (3R)-N-(2-ethylhexyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(2-ethylhexyl)piperidine-3-carboxamide
PubChem CID81141050
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name(3R)-N-(2-ethylhexyl)piperidine-3-carboxamide
SMILESCCCCC(CC)CNC(=O)[C@@H]1CCCNC1
InChIInChI=1S/C14H28N2O/c1-3-5-7-12(4-2)10-16-14(17)13-8-6-9-15-11-13/h12-13,15H,3-11H2,1-2H3,(H,16,17)/t12?,13-/m1/s1
InChIKeyQERVXLBMOGVFJB-ZGTCLIOFSA-N
XLogP2.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylhexyl)piperidine-4-carboxamide
CID 61249053
(2S,4S)-N-(2-ethylhexyl)-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120615953
N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852
(3S)-N-heptan-2-ylpiperidine-3-carboxamide
CID 81123711
N-(2-ethylhexyl)piperidine-2-carboxamide;hydrochloride
CID 119261605
N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride
CID 119330823
(3R)-N-(3-butoxypropyl)piperidine-3-carboxamide
CID 113481104
N-(4-chloro-2-ethylbutyl)cyclobutanecarboxamide
CID 114306556
N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride
CID 119842158
5-methyl-3-[(piperidine-3-carbonylamino)methyl]hexanoic acid
CID 65492071
N-(4-methylpentyl)piperidine-3-carboxamide
CID 61043776
N-(2-ethylbutyl)piperidine-4-carboxamide
CID 115733723

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(2-ethylhexyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(2-ethylhexyl)piperidine-3-carboxamide (CID 81141050) is (3R)-N-(2-ethylhexyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(2-ethylhexyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(2-ethylhexyl)piperidine-3-carboxamide is CCCCC(CC)CNC(=O)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-(2-ethylhexyl)piperidine-3-carboxamide?
The InChIKey is QERVXLBMOGVFJB-ZGTCLIOFSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-5-7-12(4-2)10-16-14(17)13-8-6-9-15-11-13/h12-13,15H,3-11H2,1-2H3,(H,16,17)/t12?,13-/m1/s1.
What are the key properties of (3R)-N-(2-ethylhexyl)piperidine-3-carboxamide?
(3R)-N-(2-ethylhexyl)piperidine-3-carboxamide has a molecular weight of 240.39 g/mol, XLogP of 2.32, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(2-ethylhexyl)piperidine-3-carboxamide is sourced from PubChem (CID 81141050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).