N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide

C15H25N5O — CID 63282846

IUPACN-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide
SMILESCN(C(=O)c1cn(C2CCNCC2)nn1)C1CCCCC1
InChIInChI=1S/C15H25N5O/c1-19(12-5-3-2-4-6-12)15(21)14-11-20(18-17-14)13-7-9-16-10-8-13/h11-13,16H,2-10H2,1H3
InChIKeyUUJMVYHOEVQZMQ-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.61
Rot. Bonds3

About N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide

N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide (PubChem CID 63282846) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide
PubChem CID63282846
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC NameN-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide
SMILESCN(C(=O)c1cn(C2CCNCC2)nn1)C1CCCCC1
InChIInChI=1S/C15H25N5O/c1-19(12-5-3-2-4-6-12)15(21)14-11-20(18-17-14)13-7-9-16-10-8-13/h11-13,16H,2-10H2,1H3
InChIKeyUUJMVYHOEVQZMQ-UHFFFAOYSA-N
XLogP1.61
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclooctyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide
CID 119763852
N-cyclopentyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119696941
N-[3-[cyclohexyl(methyl)amino]propyl]-1-piperidin-4-yltriazole-4-carboxamide;dihydrochloride
CID 119851112
N,N-diethyl-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119671423
1-(azetidin-3-yl)-N-methyl-N-(1-methylpiperidin-3-yl)triazole-4-carboxamide
CID 79315997
N-butan-2-yl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119737731
N-[(1S,3S)-3-ethoxyspiro[3.4]octan-1-yl]-N-methyl-1-piperidin-4-yltriazole-4-carboxamide
CID 124684050
N-methyl-N-(2-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-yl)-1-piperidin-4-yltriazole-4-carboxamide
CID 119886852
N-methyl-N-(2-methylsulfonylethyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 79841941
N-butyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119672309
4-[methyl-(1-piperidin-4-yltriazole-4-carbonyl)amino]butanoic acid
CID 63284811
N-butyl-N-cyclopropyl-1-piperidin-4-yltriazole-4-carboxamide
CID 63283305

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide?
The IUPAC name of N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide (CID 63282846) is N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide?
The canonical SMILES for N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide is CN(C(=O)c1cn(C2CCNCC2)nn1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide?
The InChIKey is UUJMVYHOEVQZMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-19(12-5-3-2-4-6-12)15(21)14-11-20(18-17-14)13-7-9-16-10-8-13/h11-13,16H,2-10H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide?
N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide has a molecular weight of 291.40 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide is sourced from PubChem (CID 63282846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).