(2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide

C12H14N4O — CID 64529573

IUPAC(2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide
SMILESN[C@@H](C(=O)NCc1ncc[nH]1)c1ccccc1
InChIInChI=1S/C12H14N4O/c13-11(9-4-2-1-3-5-9)12(17)16-8-10-14-6-7-15-10/h1-7,11H,8,13H2,(H,14,15)(H,16,17)/t11-/m1/s1
InChIKeyDYJUOIGEUCLNGY-LLVKDONJSA-N
MW230.27 g/mol
LogP0.73
Rot. Bonds4

About (2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide

(2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide (PubChem CID 64529573) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is (2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide
PubChem CID64529573
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name(2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide
SMILESN[C@@H](C(=O)NCc1ncc[nH]1)c1ccccc1
InChIInChI=1S/C12H14N4O/c13-11(9-4-2-1-3-5-9)12(17)16-8-10-14-6-7-15-10/h1-7,11H,8,13H2,(H,14,15)(H,16,17)/t11-/m1/s1
InChIKeyDYJUOIGEUCLNGY-LLVKDONJSA-N
XLogP0.73
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 50.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide 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

4-amino-5-(1H-imidazol-2-ylmethylamino)-5-oxopentanoic acid
CID 64889363
2-(3-aminophenyl)-N-(1H-imidazol-2-ylmethyl)propanamide
CID 106591515
2-[2-(aminomethyl)phenyl]-N-(1H-imidazol-2-ylmethyl)acetamide
CID 81321885
2-amino-N-[3-(1H-imidazol-2-yl)propyl]-2-(4-methylphenyl)acetamide
CID 106312735
4-(1H-imidazol-2-ylmethylamino)-2,3-dimethyl-4-oxobutanoic acid
CID 103498569
2-[2-(1H-imidazol-2-ylmethylamino)-2-oxoethyl]benzoic acid
CID 104601596
(2R)-2-amino-N-[1-(1H-imidazol-2-yl)propyl]-2-phenylacetamide
CID 104871611
2-amino-N-(1H-imidazol-2-ylmethyl)-3-(1H-indol-3-yl)propanamide
CID 77043322
2-amino-N-[(3-methyl-2-pyridinyl)methyl]-2-phenylacetamide
CID 63306151
3-amino-N-[2-(1H-imidazol-2-yl)ethyl]-3-phenylpropanamide
CID 115748951
2-(1H-imidazol-2-ylmethylamino)-2-phenylethanol
CID 63182355
2-(1H-imidazol-2-ylmethylamino)-2-oxoacetic acid
CID 64524937

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide?
The IUPAC name of (2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide (CID 64529573) is (2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide.
What is the SMILES notation for (2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide?
The canonical SMILES for (2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide is N[C@@H](C(=O)NCc1ncc[nH]1)c1ccccc1.
What is the InChIKey of (2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide?
The InChIKey is DYJUOIGEUCLNGY-LLVKDONJSA-N. The full InChI is InChI=1S/C12H14N4O/c13-11(9-4-2-1-3-5-9)12(17)16-8-10-14-6-7-15-10/h1-7,11H,8,13H2,(H,14,15)(H,16,17)/t11-/m1/s1.
What are the key properties of (2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide?
(2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide has a molecular weight of 230.27 g/mol, XLogP of 0.73, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide is sourced from PubChem (CID 64529573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).