N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide

C18H32N4O2 — CID 171722600

IUPACN-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide
SMILESO=C(NC1CCCC(NC(=O)C2CCNCC2)C1)C1CCNCC1
InChIInChI=1S/C18H32N4O2/c23-17(13-4-8-19-9-5-13)21-15-2-1-3-16(12-15)22-18(24)14-6-10-20-11-7-14/h13-16,19-20H,1-12H2,(H,21,23)(H,22,24)
InChIKeySIOQMTDVTWBTSO-UHFFFAOYSA-N
MW336.48 g/mol
LogP0.53
Rot. Bonds4

About N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide

N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide (PubChem CID 171722600) has the molecular formula C18H32N4O2 and a molecular weight of 336.48 g/mol. Its IUPAC name is N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide
PubChem CID171722600
Molecular FormulaC18H32N4O2
Molecular Weight336.48 g/mol
Exact Mass336.25
IUPAC NameN-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide
SMILESO=C(NC1CCCC(NC(=O)C2CCNCC2)C1)C1CCNCC1
InChIInChI=1S/C18H32N4O2/c23-17(13-4-8-19-9-5-13)21-15-2-1-3-16(12-15)22-18(24)14-6-10-20-11-7-14/h13-16,19-20H,1-12H2,(H,21,23)(H,22,24)
InChIKeySIOQMTDVTWBTSO-UHFFFAOYSA-N
XLogP0.53
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 50.53
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptylpiperidine-4-carboxamide;hydrochloride
CID 70702347
N-[(3R)-pyrrolidin-3-yl]piperidine-4-carboxamide
CID 91470745
N-piperidin-4-ylcyclopropanecarboxamide
CID 1445166
N-piperidin-4-ylcycloheptanecarboxamide
CID 62587546
N-(azepan-4-yl)cyclohexanecarboxamide
CID 105059767
N-(3-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119775883
N-cyclopentylcyclobutanecarboxamide
CID 21158774
N-[3-(trifluoromethyl)cyclohexyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119701141
N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride
CID 172899475
N-(thian-4-yl)piperidine-4-carboxamide;hydrochloride
CID 119313224
N-(azepan-4-yl)-4,4-difluorocyclohexane-1-carboxamide
CID 107172304
N-pyrrolidin-3-ylcyclopentanecarboxamide;hydrochloride
CID 146675555

Frequently Asked Questions

What is the IUPAC name of N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide?
The IUPAC name of N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide (CID 171722600) is N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide?
The canonical SMILES for N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide is O=C(NC1CCCC(NC(=O)C2CCNCC2)C1)C1CCNCC1.
What is the InChIKey of N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide?
The InChIKey is SIOQMTDVTWBTSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O2/c23-17(13-4-8-19-9-5-13)21-15-2-1-3-16(12-15)22-18(24)14-6-10-20-11-7-14/h13-16,19-20H,1-12H2,(H,21,23)(H,22,24).
What are the key properties of N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide?
N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide has a molecular weight of 336.48 g/mol, XLogP of 0.53, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide is sourced from PubChem (CID 171722600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).