N-(piperidin-3-ylmethyl)cyclohexanecarboxamide

C13H24N2O — CID 18069614

IUPACN-(piperidin-3-ylmethyl)cyclohexanecarboxamide
SMILESO=C(NCC1CCCNC1)C1CCCCC1
InChIInChI=1S/C13H24N2O/c16-13(12-6-2-1-3-7-12)15-10-11-5-4-8-14-9-11/h11-12,14H,1-10H2,(H,15,16)
InChIKeyMLLCBINQHTVWSO-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.68
Rot. Bonds3

About N-(piperidin-3-ylmethyl)cyclohexanecarboxamide

N-(piperidin-3-ylmethyl)cyclohexanecarboxamide (PubChem CID 18069614) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)cyclohexanecarboxamide
PubChem CID18069614
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-(piperidin-3-ylmethyl)cyclohexanecarboxamide
SMILESO=C(NCC1CCCNC1)C1CCCCC1
InChIInChI=1S/C13H24N2O/c16-13(12-6-2-1-3-7-12)15-10-11-5-4-8-14-9-11/h11-12,14H,1-10H2,(H,15,16)
InChIKeyMLLCBINQHTVWSO-UHFFFAOYSA-N
XLogP1.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[(3R)-piperidin-3-yl]methyl]cycloheptanecarboxamide
CID 94502290
N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride
CID 119260134
N-(cyclopentylmethyl)piperidine-3-carboxamide
CID 43371173
(3S)-N-(cyclopentylmethyl)piperidine-3-carboxamide
CID 81123262
4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119463290
2,2,3,3-tetramethyl-N-(piperidin-3-ylmethyl)cyclopropane-1-carboxamide
CID 66475790
N-(piperidin-3-ylmethyl)oxolane-3-carboxamide
CID 61271600
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide
CID 60894096
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride
CID 119557894
N-(piperidin-3-ylmethyl)azepane-1-carboxamide
CID 79152631
N-(oxan-4-ylmethyl)piperidine-3-carboxamide
CID 53410772
(3S)-N-(oxan-4-ylmethyl)piperidine-3-carboxamide
CID 81141151

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)cyclohexanecarboxamide?
The IUPAC name of N-(piperidin-3-ylmethyl)cyclohexanecarboxamide (CID 18069614) is N-(piperidin-3-ylmethyl)cyclohexanecarboxamide.
What is the SMILES notation for N-(piperidin-3-ylmethyl)cyclohexanecarboxamide?
The canonical SMILES for N-(piperidin-3-ylmethyl)cyclohexanecarboxamide is O=C(NCC1CCCNC1)C1CCCCC1.
What is the InChIKey of N-(piperidin-3-ylmethyl)cyclohexanecarboxamide?
The InChIKey is MLLCBINQHTVWSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c16-13(12-6-2-1-3-7-12)15-10-11-5-4-8-14-9-11/h11-12,14H,1-10H2,(H,15,16).
What are the key properties of N-(piperidin-3-ylmethyl)cyclohexanecarboxamide?
N-(piperidin-3-ylmethyl)cyclohexanecarboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-3-ylmethyl)cyclohexanecarboxamide is sourced from PubChem (CID 18069614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).