N-cyclohexyl-4-phenylpiperazine-1-carboxamide

C17H25N3O — CID 858165

IUPACN-cyclohexyl-4-phenylpiperazine-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C17H25N3O/c21-17(18-15-7-3-1-4-8-15)20-13-11-19(12-14-20)16-9-5-2-6-10-16/h2,5-6,9-10,15H,1,3-4,7-8,11-14H2,(H,18,21)
InChIKeyAJHXEEHTUCOXPY-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.85
Rot. Bonds2

About N-cyclohexyl-4-phenylpiperazine-1-carboxamide

N-cyclohexyl-4-phenylpiperazine-1-carboxamide (PubChem CID 858165) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is N-cyclohexyl-4-phenylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-phenylpiperazine-1-carboxamide
PubChem CID858165
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC NameN-cyclohexyl-4-phenylpiperazine-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C17H25N3O/c21-17(18-15-7-3-1-4-8-15)20-13-11-19(12-14-20)16-9-5-2-6-10-16/h2,5-6,9-10,15H,1,3-4,7-8,11-14H2,(H,18,21)
InChIKeyAJHXEEHTUCOXPY-UHFFFAOYSA-N
XLogP2.85
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-4-(4-hydroxyphenyl)piperazine-1-carboxamide
CID 4169539
N-(1-ethylazepan-3-yl)-4-phenylpiperazine-1-carboxamide
CID 15636959
N-[(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl]-4-phenylpiperazine-1-carboxamide
CID 52902639
N-cyclohexyl-4-(4-nitrophenyl)piperazine-1-carboxamide
CID 2932747
4-(4-aminophenyl)-N-cyclobutylpiperazine-1-carboxamide
CID 116653618
N-cyclopentyl-4-phenylpiperazine-1-carbothioamide
CID 892113
4-(3-cyanophenyl)-N-cyclopentylpiperazine-1-carboxamide
CID 113104573
methyl 3-[4-(cycloheptylcarbamoyl)piperazin-1-yl]benzoate
CID 113110616
4-(2-chlorophenyl)-N-cyclopentylpiperazine-1-carboxamide
CID 17412310
N-[(3S)-1,1-dioxothiolan-3-yl]-4-phenylpiperazine-1-carboxamide
CID 94017270
methyl 4-[4-(cyclopentylcarbamoyl)piperazin-1-yl]benzoate
CID 113104537
N-cycloheptyl-4-pyrimidin-2-ylpiperazine-1-carboxamide
CID 108990409

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-phenylpiperazine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-phenylpiperazine-1-carboxamide (CID 858165) is N-cyclohexyl-4-phenylpiperazine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-phenylpiperazine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-phenylpiperazine-1-carboxamide is O=C(NC1CCCCC1)N1CCN(c2ccccc2)CC1.
What is the InChIKey of N-cyclohexyl-4-phenylpiperazine-1-carboxamide?
The InChIKey is AJHXEEHTUCOXPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c21-17(18-15-7-3-1-4-8-15)20-13-11-19(12-14-20)16-9-5-2-6-10-16/h2,5-6,9-10,15H,1,3-4,7-8,11-14H2,(H,18,21).
What are the key properties of N-cyclohexyl-4-phenylpiperazine-1-carboxamide?
N-cyclohexyl-4-phenylpiperazine-1-carboxamide has a molecular weight of 287.41 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-phenylpiperazine-1-carboxamide is sourced from PubChem (CID 858165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).