1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea

C18H32N4O2 — CID 119304273

IUPAC1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea
SMILESO=C(NC1CCCCC1)NC1CCN(C(=O)C2CCNCC2)CC1
InChIInChI=1S/C18H32N4O2/c23-17(14-6-10-19-11-7-14)22-12-8-16(9-13-22)21-18(24)20-15-4-2-1-3-5-15/h14-16,19H,1-13H2,(H2,20,21,24)
InChIKeyHVJOPMSLZNJVBF-UHFFFAOYSA-N
MW336.48 g/mol
LogP1.61
Rot. Bonds3

About 1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea

1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea (PubChem CID 119304273) has the molecular formula C18H32N4O2 and a molecular weight of 336.48 g/mol. Its IUPAC name is 1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea.

Molecular Properties

Compound Name1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea
PubChem CID119304273
Molecular FormulaC18H32N4O2
Molecular Weight336.48 g/mol
Exact Mass336.25
IUPAC Name1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea
SMILESO=C(NC1CCCCC1)NC1CCN(C(=O)C2CCNCC2)CC1
InChIInChI=1S/C18H32N4O2/c23-17(14-6-10-19-11-7-14)22-12-8-16(9-13-22)21-18(24)20-15-4-2-1-3-5-15/h14-16,19H,1-13H2,(H2,20,21,24)
InChIKeyHVJOPMSLZNJVBF-UHFFFAOYSA-N
XLogP1.61
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(cyclopentanecarbonyl)piperidin-4-yl]-3-cyclopentylurea
CID 110820027
1-cyclohexyl-3-[1-[(2S,4S)-2-methylpiperidine-4-carbonyl]piperidin-4-yl]urea
CID 120625762
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]piperidine-4-carboxamide
CID 43711892
1-cyclohexyl-3-[(3S)-pyrrolidin-3-yl]urea
CID 79685110
1-tert-butyl-3-[1-(cyclohexanecarbonyl)piperidin-4-yl]urea
CID 110819716
1-(cyclohexanecarbonyl)-N-cyclopentylpiperidine-4-carboxamide
CID 113002958
(4-cyclopentyloxypiperidin-1-yl)-piperidin-4-ylmethanone
CID 119312944
N-cyclohexyl-4-(cyclopentanecarbonyl)piperazine-1-carboxamide
CID 110364760
2,2-dichloro-N-[1-(cyclohexanecarbonyl)piperidin-4-yl]acetamide
CID 108563873
N-cycloheptylpiperidine-4-carboxamide;hydrochloride
CID 70702347
1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride
CID 119750464
1-cyclobutyl-3-pyrrolidin-3-ylurea
CID 116658204

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea?
The IUPAC name of 1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea (CID 119304273) is 1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea.
What is the SMILES notation for 1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea?
The canonical SMILES for 1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea is O=C(NC1CCCCC1)NC1CCN(C(=O)C2CCNCC2)CC1.
What is the InChIKey of 1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea?
The InChIKey is HVJOPMSLZNJVBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O2/c23-17(14-6-10-19-11-7-14)22-12-8-16(9-13-22)21-18(24)20-15-4-2-1-3-5-15/h14-16,19H,1-13H2,(H2,20,21,24).
What are the key properties of 1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea?
1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea has a molecular weight of 336.48 g/mol, XLogP of 1.61, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea is sourced from PubChem (CID 119304273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).