(2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide

C15H25N3O2 — CID 57272495

IUPAC(2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide
SMILESNCCC[C@@H](N)C(=O)N(CCO)CCc1ccccc1
InChIInChI=1S/C15H25N3O2/c16-9-4-7-14(17)15(20)18(11-12-19)10-8-13-5-2-1-3-6-13/h1-3,5-6,14,19H,4,7-12,16-17H2/t14-/m1/s1
InChIKeyIRTGSQQZEDQBFY-CQSZACIVSA-N
MW279.38 g/mol
LogP0.12
Rot. Bonds9

About (2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide

(2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide (PubChem CID 57272495) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is (2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide.

Molecular Properties

Compound Name(2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide
PubChem CID57272495
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name(2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide
SMILESNCCC[C@@H](N)C(=O)N(CCO)CCc1ccccc1
InChIInChI=1S/C15H25N3O2/c16-9-4-7-14(17)15(20)18(11-12-19)10-8-13-5-2-1-3-6-13/h1-3,5-6,14,19H,4,7-12,16-17H2/t14-/m1/s1
InChIKeyIRTGSQQZEDQBFY-CQSZACIVSA-N
XLogP0.12
TPSA92.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2,5-diamino-N-(2-benzylsulfanyl-2-sulfanylethyl)-N-(2-phenylethyl)pentanamide
CID 57255392
(2S)-2-amino-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-4-phenylbutanamide
CID 104984805
(2S)-2-amino-N-(2-hydroxyethyl)-4-phenyl-N-propan-2-ylbutanamide
CID 104983951
2-amino-N-benzyl-N-(2-phenylethyl)pentanamide
CID 119264050
(2S)-2-amino-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-3-phenylpropanamide
CID 104861606
7-phenylheptane-1,4-diamine
CID 174860311
2-(3-aminopropyl)-6-phenylhexanoic acid
CID 114335136
N-(2-aminoethyl)-2-methyl-N-(2-phenylethyl)butanamide;hydrochloride
CID 120885669
(2S)-2-amino-5-phenylpentanethioic S-acid
CID 57090129
2-amino-7-phenylheptanoic acid
CID 85132413
(2S)-2,6-diamino-N-[(2S)-1-oxopropan-2-yl]-N-(4-phenylbutanoyl)hexanamide
CID 54279048
(6S)-6,9-diamino-1-phenylnonan-4-one
CID 157262351

Frequently Asked Questions

What is the IUPAC name of (2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide?
The IUPAC name of (2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide (CID 57272495) is (2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide.
What is the SMILES notation for (2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide?
The canonical SMILES for (2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide is NCCC[C@@H](N)C(=O)N(CCO)CCc1ccccc1.
What is the InChIKey of (2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide?
The InChIKey is IRTGSQQZEDQBFY-CQSZACIVSA-N. The full InChI is InChI=1S/C15H25N3O2/c16-9-4-7-14(17)15(20)18(11-12-19)10-8-13-5-2-1-3-6-13/h1-3,5-6,14,19H,4,7-12,16-17H2/t14-/m1/s1.
What are the key properties of (2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide?
(2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide has a molecular weight of 279.38 g/mol, XLogP of 0.12, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2,5-diamino-N-(2-hydroxyethyl)-N-(2-phenylethyl)pentanamide is sourced from PubChem (CID 57272495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).