5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide

C20H24N6O — CID 119555935

IUPAC5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide
SMILESCc1c(C(=O)NCCC2CCCNC2)nnn1-c1ccc2ncccc2c1
InChIInChI=1S/C20H24N6O/c1-14-19(20(27)23-11-8-15-4-2-9-21-13-15)24-25-26(14)17-6-7-18-16(12-17)5-3-10-22-18/h3,5-7,10,12,15,21H,2,4,8-9,11,13H2,1H3,(H,23,27)
InChIKeyBQBDRLOBSDZNBN-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.24
Rot. Bonds5

About 5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide

5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide (PubChem CID 119555935) has the molecular formula C20H24N6O and a molecular weight of 364.45 g/mol. Its IUPAC name is 5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide
PubChem CID119555935
Molecular FormulaC20H24N6O
Molecular Weight364.45 g/mol
Exact Mass364.20
IUPAC Name5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide
SMILESCc1c(C(=O)NCCC2CCCNC2)nnn1-c1ccc2ncccc2c1
InChIInChI=1S/C20H24N6O/c1-14-19(20(27)23-11-8-15-4-2-9-21-13-15)24-25-26(14)17-6-7-18-16(12-17)5-3-10-22-18/h3,5-7,10,12,15,21H,2,4,8-9,11,13H2,1H3,(H,23,27)
InChIKeyBQBDRLOBSDZNBN-UHFFFAOYSA-N
XLogP2.24
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide with MolForge

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Related Compounds

N-[2-(cycloheptylamino)ethyl]-5-methyl-1-quinolin-6-yltriazole-4-carboxamide
CID 119619674
1-(4-methoxyphenyl)-5-methyl-N-(2-piperidin-3-ylethyl)triazole-4-carboxamide
CID 119555823
5-methyl-N-(2-piperazin-1-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide;dihydrochloride
CID 119445748
1-(3-bromophenyl)-5-methyl-N-(2-pyrrolidin-3-ylethyl)triazole-4-carboxamide
CID 119534305
5-methyl-N-(2-piperidin-3-ylethyl)-1-(4-propan-2-yloxyphenyl)triazole-4-carboxamide;hydrochloride
CID 119556632
N-[2-(aminomethyl)cyclopentyl]-5-methyl-1-quinolin-6-yltriazole-4-carboxamide
CID 119601545
N,5-dimethyl-N-piperidin-4-yl-1-quinolin-6-yltriazole-4-carboxamide
CID 119441874
1-(3-chlorophenyl)-5-ethyl-N-(2-piperidin-3-ylethyl)triazole-4-carboxamide
CID 119555457
N-(2-amino-1-cyclopropylethyl)-5-methyl-1-quinolin-6-yltriazole-4-carboxamide;dihydrochloride
CID 119613817
5-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]-1-quinolin-6-yltriazole-4-carboxamide
CID 75462818
N-(piperidin-3-ylmethyl)quinoline-6-carboxamide
CID 62874382
1-(4-methoxyphenyl)-5-methyl-N-(piperidin-3-ylmethyl)triazole-4-carboxamide
CID 119460716

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide?
The IUPAC name of 5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide (CID 119555935) is 5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide is Cc1c(C(=O)NCCC2CCCNC2)nnn1-c1ccc2ncccc2c1.
What is the InChIKey of 5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide?
The InChIKey is BQBDRLOBSDZNBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O/c1-14-19(20(27)23-11-8-15-4-2-9-21-13-15)24-25-26(14)17-6-7-18-16(12-17)5-3-10-22-18/h3,5-7,10,12,15,21H,2,4,8-9,11,13H2,1H3,(H,23,27).
What are the key properties of 5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide?
5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 2.24, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-piperidin-3-ylethyl)-1-quinolin-6-yltriazole-4-carboxamide is sourced from PubChem (CID 119555935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).