N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide

C9H14N4O — CID 78928145

IUPACN-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide
SMILESCc1nc(NC(=O)C2CCCC2)n[nH]1
InChIInChI=1S/C9H14N4O/c1-6-10-9(13-12-6)11-8(14)7-4-2-3-5-7/h7H,2-5H2,1H3,(H2,10,11,12,13,14)
InChIKeyGSJDSDKLSDNVDQ-UHFFFAOYSA-N
MW194.24 g/mol
LogP1.24
Rot. Bonds2

About N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide

N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide (PubChem CID 78928145) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide
PubChem CID78928145
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC NameN-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide
SMILESCc1nc(NC(=O)C2CCCC2)n[nH]1
InChIInChI=1S/C9H14N4O/c1-6-10-9(13-12-6)11-8(14)7-4-2-3-5-7/h7H,2-5H2,1H3,(H2,10,11,12,13,14)
InChIKeyGSJDSDKLSDNVDQ-UHFFFAOYSA-N
XLogP1.24
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-acetyl-N-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide
CID 78927453
N-(5-methyl-1H-1,2,4-triazol-3-yl)thiolane-3-carboxamide
CID 80709247
1-(cyclopropanecarbonyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-3-carboxamide
CID 78928337
3-N-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1,3-dicarboxamide
CID 78927822
N-(5-methyl-1H-1,2,4-triazol-3-yl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 86207135
2-methyl-N-(5-methyl-1H-1,2,4-triazol-3-yl)oxane-3-carboxamide
CID 154735472
N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]cyclopentanecarboxamide
CID 9246816
N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide
CID 51081301
N-(5-methyl-1H-pyrazol-3-yl)cyclooctanecarboxamide
CID 65022914
N-(5-methyl-1H-1,2,4-triazol-3-yl)-2-(oxolan-2-yl)acetamide
CID 78928233
2,3-dimethyl-N-(5-methyl-1H-1,2,4-triazol-3-yl)butanamide
CID 78958095
ethyl 2-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]-2-oxoacetate
CID 110471089

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide?
The IUPAC name of N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide (CID 78928145) is N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide is Cc1nc(NC(=O)C2CCCC2)n[nH]1.
What is the InChIKey of N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide?
The InChIKey is GSJDSDKLSDNVDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c1-6-10-9(13-12-6)11-8(14)7-4-2-3-5-7/h7H,2-5H2,1H3,(H2,10,11,12,13,14).
What are the key properties of N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide?
N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide has a molecular weight of 194.24 g/mol, XLogP of 1.24, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopentanecarboxamide is sourced from PubChem (CID 78928145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).