4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine

C14H24N4 — CID 177025421

IUPAC4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine
SMILESCC1CCC(n2cc(C3CCNCC3)nn2)CC1
InChIInChI=1S/C14H24N4/c1-11-2-4-13(5-3-11)18-10-14(16-17-18)12-6-8-15-9-7-12/h10-13,15H,2-9H2,1H3
InChIKeyADTNYFWEPXGMJY-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.50
Rot. Bonds2

About 4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine

4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine (PubChem CID 177025421) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine.

Molecular Properties

Compound Name4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine
PubChem CID177025421
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine
SMILESCC1CCC(n2cc(C3CCNCC3)nn2)CC1
InChIInChI=1S/C14H24N4/c1-11-2-4-13(5-3-11)18-10-14(16-17-18)12-6-8-15-9-7-12/h10-13,15H,2-9H2,1H3
InChIKeyADTNYFWEPXGMJY-UHFFFAOYSA-N
XLogP2.50
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-cycloheptyl-1-pyrrolidin-3-yltriazole
CID 115040470
1,4-dicyclohexyltriazole
CID 46204135
4-(1-propan-2-yltriazol-4-yl)piperidine
CID 84773229
2-[1-(4-methylcyclohexyl)triazol-4-yl]ethanamine
CID 116641962
4-(1-bromoethyl)-1-(4-methylcyclohexyl)triazole
CID 81449692
N,N-dimethyl-3-[1-(4-methylcyclohexyl)triazol-4-yl]bicyclo[1.1.1]pentan-1-amine
CID 155261068
4-cyclopropyl-1-(1-ethylsulfonylpyrrolidin-3-yl)triazole
CID 121190734
3-(4-pyrrolidin-3-yltriazol-1-yl)pyrrolidin-2-one
CID 154866029
(1-piperidin-4-yltriazol-4-yl)methanol;hydrochloride
CID 86262656
4-[4-(3-methylphenyl)triazol-1-yl]piperidine
CID 21219151
3-(4-cyclopropyltriazol-1-yl)-N,N-dimethylpyrrolidine-1-sulfonamide
CID 121190795
4-(4-cyclopropyltriazol-1-yl)-1-(2-methylbutyl)piperidine
CID 46993628

Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine?
The IUPAC name of 4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine (CID 177025421) is 4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine.
What is the SMILES notation for 4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine?
The canonical SMILES for 4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine is CC1CCC(n2cc(C3CCNCC3)nn2)CC1.
What is the InChIKey of 4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine?
The InChIKey is ADTNYFWEPXGMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-11-2-4-13(5-3-11)18-10-14(16-17-18)12-6-8-15-9-7-12/h10-13,15H,2-9H2,1H3.
What are the key properties of 4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine?
4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine has a molecular weight of 248.37 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-methylcyclohexyl)triazol-4-yl]piperidine is sourced from PubChem (CID 177025421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).