1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide

C15H19N5O — CID 119311512

IUPAC1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide
SMILESCc1nc(-c2ccc(NC(=O)C3(N)CCCC3)cc2)n[nH]1
InChIInChI=1S/C15H19N5O/c1-10-17-13(20-19-10)11-4-6-12(7-5-11)18-14(21)15(16)8-2-3-9-15/h4-7H,2-3,8-9,16H2,1H3,(H,18,21)(H,17,19,20)
InChIKeyQBOIZROCYOMXCQ-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.99
Rot. Bonds3

About 1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide

1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide (PubChem CID 119311512) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide
PubChem CID119311512
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide
SMILESCc1nc(-c2ccc(NC(=O)C3(N)CCCC3)cc2)n[nH]1
InChIInChI=1S/C15H19N5O/c1-10-17-13(20-19-10)11-4-6-12(7-5-11)18-14(21)15(16)8-2-3-9-15/h4-7H,2-3,8-9,16H2,1H3,(H,18,21)(H,17,19,20)
InChIKeyQBOIZROCYOMXCQ-UHFFFAOYSA-N
XLogP1.99
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-[4-(2H-tetrazol-5-yl)phenyl]cyclohexane-1-carboxamide
CID 119312969
4-(4-fluorophenyl)-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]oxane-4-carboxamide
CID 49422466
1-amino-N-[[3-(4-methoxyphenyl)-1H-1,2,4-triazol-5-yl]methyl]cyclohexane-1-carboxamide
CID 119319187
1-[5-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine
CID 166216352
cis-(1S,2R)-2-[[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 166288343
4-[4-[[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]carbamoyl]phenoxy]benzamide
CID 56548127
1-amino-N-(4-fluorophenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119261942
1-amino-N-(4-ethylphenyl)cyclopentane-1-carboxamide
CID 60867224
N-[4-[5-(aminomethyl)-1H-1,2,4-triazol-3-yl]phenyl]-1-(ethylcarbamoylamino)cyclopentane-1-carboxamide
CID 120566637
2-(4-ethylpiperazin-1-yl)-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]acetamide
CID 131930825
9-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120988110
N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]piperidine-3-carboxamide
CID 119311516

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide (CID 119311512) is 1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide is Cc1nc(-c2ccc(NC(=O)C3(N)CCCC3)cc2)n[nH]1.
What is the InChIKey of 1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide?
The InChIKey is QBOIZROCYOMXCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-10-17-13(20-19-10)11-4-6-12(7-5-11)18-14(21)15(16)8-2-3-9-15/h4-7H,2-3,8-9,16H2,1H3,(H,18,21)(H,17,19,20).
What are the key properties of 1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide?
1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.99, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119311512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).