N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide

C15H25N5O — CID 110194759

IUPACN-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide
SMILESCc1nc(C2CCCCN2C(=O)NC2CCCCC2)n[nH]1
InChIInChI=1S/C15H25N5O/c1-11-16-14(19-18-11)13-9-5-6-10-20(13)15(21)17-12-7-3-2-4-8-12/h12-13H,2-10H2,1H3,(H,17,21)(H,16,18,19)
InChIKeyMQAZUHSNJYWHAY-UHFFFAOYSA-N
MW291.40 g/mol
LogP2.68
Rot. Bonds2

About N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide

N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide (PubChem CID 110194759) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide
PubChem CID110194759
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC NameN-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide
SMILESCc1nc(C2CCCCN2C(=O)NC2CCCCC2)n[nH]1
InChIInChI=1S/C15H25N5O/c1-11-16-14(19-18-11)13-9-5-6-10-20(13)15(21)17-12-7-3-2-4-8-12/h12-13H,2-10H2,1H3,(H,17,21)(H,16,18,19)
InChIKeyMQAZUHSNJYWHAY-UHFFFAOYSA-N
XLogP2.68
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidine-1-carboxamide
CID 75443339
N-propan-2-yl-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)piperidine-1-carboxamide
CID 118740588
2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine dihydrochloride
CID 91662957
2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine
CID 61276907
2-(5-cyclopropyl-4H-1,2,4-triazol-3-yl)-N-propyltetrahydro-1(2H)-pyridinecarboxamide
CID 91903861
2-(5-methyl-1H-1,2,4-triazol-3-yl)-N-propylpiperidine-1-carboxamide
CID 110194762
N-methyl-2-[(2S)-2-methylpiperidin-1-yl]-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]ethanamine
CID 124755825
N-((1r,4r)-4-aminocyclohexyl)-5-ethyl-1H-1,2,4-triazole-3-carboxamide
CID 80372704
N-((1r,4r)-4-aminocyclohexyl)-5-methyl-1H-1,2,4-triazole-3-carboxamide
CID 80372864
2-methyl-1-[5-(2,2,2-trifluoroethyl)-1H-1,2,4-triazol-3-yl]piperidin-3-amine
CID 102798671
2-methyl-1-[5-(3,3,3-trifluoropropyl)-1H-1,2,4-triazol-3-yl]piperidin-3-amine
CID 102798763
2-[rac-(2R,6S)-2,6-dimethylpiperidin-1-yl]-N-{[3-(trifluoromethyl)-1H-1,2,4-triazol-5-yl]methyl}acetamide
CID 119068030

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide (CID 110194759) is N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide is Cc1nc(C2CCCCN2C(=O)NC2CCCCC2)n[nH]1.
What is the InChIKey of N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide?
The InChIKey is MQAZUHSNJYWHAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-11-16-14(19-18-11)13-9-5-6-10-20(13)15(21)17-12-7-3-2-4-8-12/h12-13H,2-10H2,1H3,(H,17,21)(H,16,18,19).
What are the key properties of N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide?
N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide has a molecular weight of 291.40 g/mol, XLogP of 2.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 110194759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).