(2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide

C14H27N3O — CID 103814109

IUPAC(2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide
SMILESCCN1CCC(CNC(=O)[C@H]2CCCCN2)CC1
InChIInChI=1S/C14H27N3O/c1-2-17-9-6-12(7-10-17)11-16-14(18)13-5-3-4-8-15-13/h12-13,15H,2-11H2,1H3,(H,16,18)/t13-/m1/s1
InChIKeyBLRKOQFDCITBED-CYBMUJFWSA-N
MW253.39 g/mol
LogP0.98
Rot. Bonds4

About (2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide

(2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide (PubChem CID 103814109) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is (2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide
PubChem CID103814109
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name(2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide
SMILESCCN1CCC(CNC(=O)[C@H]2CCCCN2)CC1
InChIInChI=1S/C14H27N3O/c1-2-17-9-6-12(7-10-17)11-16-14(18)13-5-3-4-8-15-13/h12-13,15H,2-11H2,1H3,(H,16,18)/t13-/m1/s1
InChIKeyBLRKOQFDCITBED-CYBMUJFWSA-N
XLogP0.98
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide
CID 103814111
(2S)-N-[(1-ethylpyrrolidin-3-yl)methyl]piperidine-2-carboxamide
CID 113267408
(2S)-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide;dihydrochloride
CID 119866896
N-(cyclooctylmethyl)piperidine-2-carboxamide;hydrochloride
CID 119299438
N-(cyclobutylmethyl)azepane-2-carboxamide
CID 64564563
(2R)-N-[(4-hydroxycyclohexyl)methyl]piperidine-2-carboxamide
CID 106135357
(2R)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]piperidine-2-carboxamide
CID 103814104
N-[[1-(2,2,2-trifluoroacetyl)piperidin-4-yl]methyl]piperidine-2-carboxamide;hydrochloride
CID 119336677
(2R)-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidine-2-carboxamide
CID 103813237
N-[(1-ethylpyrrolidin-2-yl)methyl]piperidine-2-carboxamide
CID 18072841
N-[(4-ethylcyclohexyl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119300473
N-[(4-ethylmorpholin-2-yl)methyl]azepane-2-carboxamide
CID 114399899

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide?
The IUPAC name of (2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide (CID 103814109) is (2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide?
The canonical SMILES for (2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide is CCN1CCC(CNC(=O)[C@H]2CCCCN2)CC1.
What is the InChIKey of (2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide?
The InChIKey is BLRKOQFDCITBED-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H27N3O/c1-2-17-9-6-12(7-10-17)11-16-14(18)13-5-3-4-8-15-13/h12-13,15H,2-11H2,1H3,(H,16,18)/t13-/m1/s1.
What are the key properties of (2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide?
(2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide is sourced from PubChem (CID 103814109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).