N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide

C16H26N4O2 — CID 46958733

IUPACN-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide
SMILESCn1ccnc1C1(O)CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C16H26N4O2/c1-19-12-9-17-14(19)16(22)7-10-20(11-8-16)15(21)18-13-5-3-2-4-6-13/h9,12-13,22H,2-8,10-11H2,1H3,(H,18,21)
InChIKeyKFLQWPHACJZEEH-UHFFFAOYSA-N
MW306.41 g/mol
LogP1.75
Rot. Bonds2

About N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide

N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide (PubChem CID 46958733) has the molecular formula C16H26N4O2 and a molecular weight of 306.41 g/mol. Its IUPAC name is N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide
PubChem CID46958733
Molecular FormulaC16H26N4O2
Molecular Weight306.41 g/mol
Exact Mass306.21
IUPAC NameN-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide
SMILESCn1ccnc1C1(O)CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C16H26N4O2/c1-19-12-9-17-14(19)16(22)7-10-20(11-8-16)15(21)18-13-5-3-2-4-6-13/h9,12-13,22H,2-8,10-11H2,1H3,(H,18,21)
InChIKeyKFLQWPHACJZEEH-UHFFFAOYSA-N
XLogP1.75
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1S,5S)-N-cyclohexyl-3-hydroxy-3-(1-methylimidazol-2-yl)-8-azabicyclo[3.2.1]octane-8-carboxamide
CID 98060172
1-[(4R)-4-hydroxy-4-(1-methylimidazol-2-yl)azepan-1-yl]ethanone
CID 124952993
N-cyclohexyl-4-hydroxy-4-(4-methoxyphenyl)piperidine-1-carboxamide
CID 645525
1-[4-hydroxy-4-(1-methylimidazol-2-yl)piperidin-1-yl]butan-1-one
CID 123381953
N-cycloheptyl-4-pyrimidin-2-ylpiperazine-1-carboxamide
CID 108990409
N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide
CID 115605548
N-cyclobutyl-4-hydroxy-4-methylazepane-1-carboxamide
CID 107404109
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
(4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide
CID 72870335
N-cyclopropyl-4-hydroxy-4-methylazepane-1-carboxamide
CID 107404102
N-(4-tert-butylcycloheptyl)-3-(1-methylimidazol-2-yl)pyrrolidine-1-carboxamide
CID 127982606
N-cyclopentyl-5-hydroxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 72870415

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide (CID 46958733) is N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide is Cn1ccnc1C1(O)CCN(C(=O)NC2CCCCC2)CC1.
What is the InChIKey of N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide?
The InChIKey is KFLQWPHACJZEEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O2/c1-19-12-9-17-14(19)16(22)7-10-20(11-8-16)15(21)18-13-5-3-2-4-6-13/h9,12-13,22H,2-8,10-11H2,1H3,(H,18,21).
What are the key properties of N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide?
N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide has a molecular weight of 306.41 g/mol, XLogP of 1.75, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 46958733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).