2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide

C11H17N3O — CID 42645281

IUPAC2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide
SMILESNCC(=O)NC[C@H](N)Cc1ccccc1
InChIInChI=1S/C11H17N3O/c12-7-11(15)14-8-10(13)6-9-4-2-1-3-5-9/h1-5,10H,6-8,12-13H2,(H,14,15)/t10-/m1/s1
InChIKeyOTXIXYSFGHUGEN-SNVBAGLBSA-N
MW207.28 g/mol
LogP-0.37
Rot. Bonds5

About 2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide

2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide (PubChem CID 42645281) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide
PubChem CID42645281
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide
SMILESNCC(=O)NC[C@H](N)Cc1ccccc1
InChIInChI=1S/C11H17N3O/c12-7-11(15)14-8-10(13)6-9-4-2-1-3-5-9/h1-5,10H,6-8,12-13H2,(H,14,15)/t10-/m1/s1
InChIKeyOTXIXYSFGHUGEN-SNVBAGLBSA-N
XLogP-0.37
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 5-0.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide?
The IUPAC name of 2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide (CID 42645281) is 2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide.
What is the SMILES notation for 2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide?
The canonical SMILES for 2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide is NCC(=O)NC[C@H](N)Cc1ccccc1.
What is the InChIKey of 2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide?
The InChIKey is OTXIXYSFGHUGEN-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H17N3O/c12-7-11(15)14-8-10(13)6-9-4-2-1-3-5-9/h1-5,10H,6-8,12-13H2,(H,14,15)/t10-/m1/s1.
What are the key properties of 2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide?
2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide has a molecular weight of 207.28 g/mol, XLogP of -0.37, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(2R)-2-amino-3-phenylpropyl]acetamide is sourced from PubChem (CID 42645281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).