(2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide

C10H19N5O — CID 103797782

IUPAC(2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide
SMILESCCC[C@@H](N)C(=O)NCCc1ncn(C)n1
InChIInChI=1S/C10H19N5O/c1-3-4-8(11)10(16)12-6-5-9-13-7-15(2)14-9/h7-8H,3-6,11H2,1-2H3,(H,12,16)/t8-/m1/s1
InChIKeyZLGNHFHEEURMMY-MRVPVSSYSA-N
MW225.30 g/mol
LogP-0.40
Rot. Bonds6

About (2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide

(2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide (PubChem CID 103797782) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide
PubChem CID103797782
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC Name(2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide
SMILESCCC[C@@H](N)C(=O)NCCc1ncn(C)n1
InChIInChI=1S/C10H19N5O/c1-3-4-8(11)10(16)12-6-5-9-13-7-15(2)14-9/h7-8H,3-6,11H2,1-2H3,(H,12,16)/t8-/m1/s1
InChIKeyZLGNHFHEEURMMY-MRVPVSSYSA-N
XLogP-0.40
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide?
The IUPAC name of (2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide (CID 103797782) is (2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide is CCC[C@@H](N)C(=O)NCCc1ncn(C)n1.
What is the InChIKey of (2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide?
The InChIKey is ZLGNHFHEEURMMY-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-3-4-8(11)10(16)12-6-5-9-13-7-15(2)14-9/h7-8H,3-6,11H2,1-2H3,(H,12,16)/t8-/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide?
(2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide has a molecular weight of 225.30 g/mol, XLogP of -0.40, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pentanamide is sourced from PubChem (CID 103797782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).