2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide

C10H16N4O — CID 103725330

IUPAC2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide
SMILESO=C(CC1CCC1)NCCc1ncn[nH]1
InChIInChI=1S/C10H16N4O/c15-10(6-8-2-1-3-8)11-5-4-9-12-7-13-14-9/h7-8H,1-6H2,(H,11,15)(H,12,13,14)
InChIKeyOYWWADKLBHWSOV-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.65
Rot. Bonds5

About 2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide

2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide (PubChem CID 103725330) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide
PubChem CID103725330
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide
SMILESO=C(CC1CCC1)NCCc1ncn[nH]1
InChIInChI=1S/C10H16N4O/c15-10(6-8-2-1-3-8)11-5-4-9-12-7-13-14-9/h7-8H,1-6H2,(H,11,15)(H,12,13,14)
InChIKeyOYWWADKLBHWSOV-UHFFFAOYSA-N
XLogP0.65
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide
CID 64532137
3-piperidin-3-yl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide
CID 64530153
1-cyclopentyl-1-methyl-3-[2-(1H-1,2,4-triazol-5-yl)ethyl]urea
CID 131960676
3-piperidin-3-yl-N-[3-(1H-1,2,4-triazol-5-yl)propyl]propanamide
CID 64531341
3-methyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]cyclohexane-1-carboxamide
CID 71980106
2-[(4R)-3,4-dihydro-2H-chromen-4-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide
CID 96525406
2-(1,1-dioxo-1,4-thiazinan-3-yl)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide
CID 80520792
2-amino-N-[2-oxo-2-[2-(1H-1,2,4-triazol-5-yl)ethylamino]ethyl]acetamide
CID 64532139
2-amino-2-cyclopropyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide
CID 64532140
2-phenyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide
CID 64545677
1-[2-oxo-2-[2-(1H-1,2,4-triazol-5-yl)ethylamino]ethyl]cyclohexane-1-carboxylic acid
CID 64545613
2-[1-[2-(1H-1,2,4-triazol-5-yl)ethylcarbamoyl]azetidin-3-yl]acetic acid
CID 64618296

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide?
The IUPAC name of 2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide (CID 103725330) is 2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide.
What is the SMILES notation for 2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide?
The canonical SMILES for 2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide is O=C(CC1CCC1)NCCc1ncn[nH]1.
What is the InChIKey of 2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide?
The InChIKey is OYWWADKLBHWSOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c15-10(6-8-2-1-3-8)11-5-4-9-12-7-13-14-9/h7-8H,1-6H2,(H,11,15)(H,12,13,14).
What are the key properties of 2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide?
2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide has a molecular weight of 208.26 g/mol, XLogP of 0.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide is sourced from PubChem (CID 103725330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).