N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide

C14H24N6O — CID 63284768

IUPACN-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide
SMILESNC1CCC(NC(=O)c2cn(C3CCNCC3)nn2)CC1
InChIInChI=1S/C14H24N6O/c15-10-1-3-11(4-2-10)17-14(21)13-9-20(19-18-13)12-5-7-16-8-6-12/h9-12,16H,1-8,15H2,(H,17,21)
InChIKeyRHXDZYNYWFPLOL-UHFFFAOYSA-N
MW292.39 g/mol
LogP0.20
Rot. Bonds3

About N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide

N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide (PubChem CID 63284768) has the molecular formula C14H24N6O and a molecular weight of 292.39 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide
PubChem CID63284768
Molecular FormulaC14H24N6O
Molecular Weight292.39 g/mol
Exact Mass292.20
IUPAC NameN-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide
SMILESNC1CCC(NC(=O)c2cn(C3CCNCC3)nn2)CC1
InChIInChI=1S/C14H24N6O/c15-10-1-3-11(4-2-10)17-14(21)13-9-20(19-18-13)12-5-7-16-8-6-12/h9-12,16H,1-8,15H2,(H,17,21)
InChIKeyRHXDZYNYWFPLOL-UHFFFAOYSA-N
XLogP0.20
TPSA97.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 50.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

1-(4-aminocyclohexyl)-N-[(3S)-piperidin-3-yl]triazole-4-carboxamide
CID 70768511
N-[4-(cyclopropylcarbamoylamino)phenyl]-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119702447
N-[1-(2-methylpropyl)piperidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide
CID 119841077
N-(3-ethylcyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 119793298
N-(3-phenylcyclobutyl)-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119774767
N-(3-anilinocyclobutyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 167792374
N-(5-amino-5-oxopentyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 106235634
N-(1-ethylpiperidin-3-yl)-1-piperidin-4-yltriazole-4-carboxamide
CID 119862379
N-(2-acetamidoethyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 63283255
N-(2-cyclohexylethyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 119725715
N-(cyclobutylmethyl)-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119724139
N-(6-hydroxyhexyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 107842557

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide?
The IUPAC name of N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide (CID 63284768) is N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide?
The canonical SMILES for N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide is NC1CCC(NC(=O)c2cn(C3CCNCC3)nn2)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide?
The InChIKey is RHXDZYNYWFPLOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6O/c15-10-1-3-11(4-2-10)17-14(21)13-9-20(19-18-13)12-5-7-16-8-6-12/h9-12,16H,1-8,15H2,(H,17,21).
What are the key properties of N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide?
N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide has a molecular weight of 292.39 g/mol, XLogP of 0.20, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide is sourced from PubChem (CID 63284768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).