N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide

C20H20N4O — CID 16648320

IUPACN-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide
SMILESO=C(NC1CCCC1)c1ccc(-n2nncc2-c2ccccc2)cc1
InChIInChI=1S/C20H20N4O/c25-20(22-17-8-4-5-9-17)16-10-12-18(13-11-16)24-19(14-21-23-24)15-6-2-1-3-7-15/h1-3,6-7,10-14,17H,4-5,8-9H2,(H,22,25)
InChIKeyZXTAIXFMMHECTA-UHFFFAOYSA-N
MW332.41 g/mol
LogP3.61
Rot. Bonds4

About N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide

N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide (PubChem CID 16648320) has the molecular formula C20H20N4O and a molecular weight of 332.41 g/mol. Its IUPAC name is N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide
PubChem CID16648320
Molecular FormulaC20H20N4O
Molecular Weight332.41 g/mol
Exact Mass332.16
IUPAC NameN-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide
SMILESO=C(NC1CCCC1)c1ccc(-n2nncc2-c2ccccc2)cc1
InChIInChI=1S/C20H20N4O/c25-20(22-17-8-4-5-9-17)16-10-12-18(13-11-16)24-19(14-21-23-24)15-6-2-1-3-7-15/h1-3,6-7,10-14,17H,4-5,8-9H2,(H,22,25)
InChIKeyZXTAIXFMMHECTA-UHFFFAOYSA-N
XLogP3.61
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide
CID 4862165
4-ethoxy-N-[4-(5-phenyltriazol-1-yl)phenyl]benzamide
CID 4607440
4-[5-(4-bromophenyl)triazol-1-yl]-N-(oxolan-2-ylmethyl)benzamide
CID 16652457
4-(benzimidazol-1-yl)-N-cyclopentylbenzamide
CID 22110686
1-cyclohexyl-3-[(3-phenyltriazol-4-yl)methyl]urea
CID 110874889
2-cyano-N-[4-(5-phenyltriazol-1-yl)phenyl]acetamide
CID 168523626
4-[5-(4-bromophenyl)triazol-1-yl]-N-(2-hydroxyethyl)benzamide
CID 16652463
4-benzamido-N-cyclopentylbenzamide
CID 1262350
N-[4-(5-phenyltriazol-1-yl)phenyl]furan-2-carboxamide
CID 5184795
N-cycloheptyl-4-(3,5-dimethyl-1,2,4-triazol-4-yl)benzamide
CID 22583363
N-[2-(cyclopentylamino)-2-oxoethyl]-4-phenylbenzamide
CID 18129640
N-[1-(cyclobutanecarbonyl)piperidin-4-yl]-4-phenylbenzamide
CID 52898200

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide?
The IUPAC name of N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide (CID 16648320) is N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide.
What is the SMILES notation for N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide?
The canonical SMILES for N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide is O=C(NC1CCCC1)c1ccc(-n2nncc2-c2ccccc2)cc1.
What is the InChIKey of N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide?
The InChIKey is ZXTAIXFMMHECTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O/c25-20(22-17-8-4-5-9-17)16-10-12-18(13-11-16)24-19(14-21-23-24)15-6-2-1-3-7-15/h1-3,6-7,10-14,17H,4-5,8-9H2,(H,22,25).
What are the key properties of N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide?
N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide has a molecular weight of 332.41 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide is sourced from PubChem (CID 16648320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).