2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide

C14H17N5O — CID 60842162

IUPAC2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide
SMILESCn1cnnc1-c1ccccc1NC(=O)CNC1CC1
InChIInChI=1S/C14H17N5O/c1-19-9-16-18-14(19)11-4-2-3-5-12(11)17-13(20)8-15-10-6-7-10/h2-5,9-10,15H,6-8H2,1H3,(H,17,20)
InChIKeyOUWMBJXXTUJZRF-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.17
Rot. Bonds5

About 2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide

2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide (PubChem CID 60842162) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide
PubChem CID60842162
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide
SMILESCn1cnnc1-c1ccccc1NC(=O)CNC1CC1
InChIInChI=1S/C14H17N5O/c1-19-9-16-18-14(19)11-4-2-3-5-12(11)17-13(20)8-15-10-6-7-10/h2-5,9-10,15H,6-8H2,1H3,(H,17,20)
InChIKeyOUWMBJXXTUJZRF-UHFFFAOYSA-N
XLogP1.17
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-[2-[2-(4-methyl-1,2,4-triazol-3-yl)anilino]-2-oxoethyl]acetamide
CID 60846960
N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]pyrrolidine-2-carboxamide
CID 43706680
2-(2-aminoethoxy)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide
CID 79473385
N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]pyrrolidine-3-carboxamide
CID 63007220
N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]piperidine-3-carboxamide
CID 43706685
2-bromo-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]propanamide
CID 114014344
4-amino-2-methyl-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]butanamide
CID 80543408
2-(aminomethyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]butanamide
CID 65224910
N-[2-methyl-3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-2-piperidin-4-ylacetamide;hydrochloride
CID 154912762
2-(cyclopropylamino)-N-(2-methyl-3-pyridinyl)acetamide
CID 79043374
N-(2-tert-butylphenyl)-2-(cyclopropylamino)acetamide
CID 54773215
2-methyl-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]oxolan-3-amine
CID 82727759

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide?
The IUPAC name of 2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide (CID 60842162) is 2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide?
The canonical SMILES for 2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide is Cn1cnnc1-c1ccccc1NC(=O)CNC1CC1.
What is the InChIKey of 2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide?
The InChIKey is OUWMBJXXTUJZRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-19-9-16-18-14(19)11-4-2-3-5-12(11)17-13(20)8-15-10-6-7-10/h2-5,9-10,15H,6-8H2,1H3,(H,17,20).
What are the key properties of 2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide?
2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide has a molecular weight of 271.32 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]acetamide is sourced from PubChem (CID 60842162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).