2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide

C15H21N5O — CID 166252019

IUPAC2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide
SMILESCCn1cc(CN(CC(N)=O)[C@H](C)c2ccccc2)nn1
InChIInChI=1S/C15H21N5O/c1-3-20-10-14(17-18-20)9-19(11-15(16)21)12(2)13-7-5-4-6-8-13/h4-8,10,12H,3,9,11H2,1-2H3,(H2,16,21)/t12-/m1/s1
InChIKeyOEVAHBPCLQXSBS-GFCCVEGCSA-N
MW287.37 g/mol
LogP1.35
Rot. Bonds7

About 2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide

2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide (PubChem CID 166252019) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide.

Molecular Properties

Compound Name2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide
PubChem CID166252019
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide
SMILESCCn1cc(CN(CC(N)=O)[C@H](C)c2ccccc2)nn1
InChIInChI=1S/C15H21N5O/c1-3-20-10-14(17-18-20)9-19(11-15(16)21)12(2)13-7-5-4-6-8-13/h4-8,10,12H,3,9,11H2,1-2H3,(H2,16,21)/t12-/m1/s1
InChIKeyOEVAHBPCLQXSBS-GFCCVEGCSA-N
XLogP1.35
TPSA77.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[1-(3-methylbut-2-enyl)triazol-4-yl]methyl-[(1R)-1-phenylethyl]amino]acetamide
CID 166252027
2-[[1-[(1-methylimidazol-2-yl)methyl]triazol-4-yl]methyl-[(1R)-1-phenylethyl]amino]acetamide
CID 166252017
(2S)-1-(1-ethyltriazol-4-yl)propan-2-amine
CID 125458566
2-[butan-2-yl-[(1-phenyltriazol-4-yl)methyl]amino]acetic acid;hydrochloride
CID 91646080
2-[1-(4-aminophenyl)ethyl-ethylamino]acetamide
CID 103101327
2-[4-(aminomethyl)triazol-1-yl]-N-[(1R)-1-phenylethyl]acetamide
CID 115459911
2-[(2-amino-1-phenylethyl)-ethylamino]acetamide
CID 103101334
2-[1-(3-hydroxybutyl)triazol-4-yl]acetic acid
CID 107461319
3-[1-(1-ethyltriazol-4-yl)butan-2-yl]phenol
CID 112718351
(2S)-2-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]propanamide;hydrochloride
CID 119337389
2-[pentyl(1-phenylethyl)amino]acetic acid
CID 70551743
2-[(2-amino-1-phenylethyl)-(2-methylpropyl)amino]acetamide
CID 55017214

Frequently Asked Questions

What is the IUPAC name of 2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide?
The IUPAC name of 2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide (CID 166252019) is 2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide.
What is the SMILES notation for 2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide?
The canonical SMILES for 2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide is CCn1cc(CN(CC(N)=O)[C@H](C)c2ccccc2)nn1.
What is the InChIKey of 2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide?
The InChIKey is OEVAHBPCLQXSBS-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H21N5O/c1-3-20-10-14(17-18-20)9-19(11-15(16)21)12(2)13-7-5-4-6-8-13/h4-8,10,12H,3,9,11H2,1-2H3,(H2,16,21)/t12-/m1/s1.
What are the key properties of 2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide?
2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide has a molecular weight of 287.37 g/mol, XLogP of 1.35, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-ethyltriazol-4-yl)methyl-[(1R)-1-phenylethyl]amino]acetamide is sourced from PubChem (CID 166252019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).