2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide

C10H16N4O — CID 60982095

IUPAC2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide
SMILESO=C(CC1CCCC1)NCc1ncn[nH]1
InChIInChI=1S/C10H16N4O/c15-10(5-8-3-1-2-4-8)11-6-9-12-7-13-14-9/h7-8H,1-6H2,(H,11,15)(H,12,13,14)
InChIKeyVUZDUXPZQAQSGO-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.00
Rot. Bonds4

About 2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide

2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide (PubChem CID 60982095) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide
PubChem CID60982095
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide
SMILESO=C(CC1CCCC1)NCc1ncn[nH]1
InChIInChI=1S/C10H16N4O/c15-10(5-8-3-1-2-4-8)11-6-9-12-7-13-14-9/h7-8H,1-6H2,(H,11,15)(H,12,13,14)
InChIKeyVUZDUXPZQAQSGO-UHFFFAOYSA-N
XLogP1.00
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-Ethylhexyl)-1H-1,2,4-triazole-3-carboxamide
CID 580553
N-[1-(4-isopropyl-4H-1,2,4-triazol-3-yl)ethyl]cyclopentanecarboxamide
CID 45199342
N-[(3-cyclopropyl-1H-1,2,4-triazol-5-yl)methyl]-4-ethylcyclohexanecarboxamide
CID 50980478
1-(4-cyclopentylbutan-2-yl)-3-[1-(1H-1,2,4-triazol-5-yl)ethyl]urea
CID 75483889
N-[[(3R)-1-[(2-ethyl-1,2,4-triazol-3-yl)methyl]pyrrolidin-3-yl]methyl]cyclohexanecarboxamide
CID 95216280
N-[1-(1H-1,2,4-triazol-5-yl)ethyl]bicyclo[4.1.0]heptane-7-carboxamide
CID 113252233
N-[(2-ethyl-1,2,4-triazol-3-yl)methyl]bicyclo[3.1.0]hexane-6-carboxamide
CID 119037063
4-[(2-cyclohexylacetyl)amino]-N-methyl-N-(1H-1,2,4-triazol-5-ylmethyl)cyclohexane-1-carboxamide
CID 126795725
cis-(1R,3S)-1,2,2,3-tetramethyl-N-(1H-1,2,4-triazol-5-ylmethyl)cyclopentane-1-carboxamide
CID 137995501
N-(1H-1,2,4-triazol-5-ylmethyl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 78977006
N-[3-(1H-1,2,4-triazol-5-yl)propyl]-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 79001352
N-methyl-N-(1H-1,2,4-triazol-5-ylmethyl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 79001371

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide?
The IUPAC name of 2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide (CID 60982095) is 2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide.
What is the SMILES notation for 2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide?
The canonical SMILES for 2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide is O=C(CC1CCCC1)NCc1ncn[nH]1.
What is the InChIKey of 2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide?
The InChIKey is VUZDUXPZQAQSGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c15-10(5-8-3-1-2-4-8)11-6-9-12-7-13-14-9/h7-8H,1-6H2,(H,11,15)(H,12,13,14).
What are the key properties of 2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide?
2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide has a molecular weight of 208.26 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide is sourced from PubChem (CID 60982095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).