(2S)-2-amino-N-(2-hydroxyethyl)pentanamide

C7H16N2O2 — CID 89064333

IUPAC(2S)-2-amino-N-(2-hydroxyethyl)pentanamide
SMILESCCC[C@H](N)C(=O)NCCO
InChIInChI=1S/C7H16N2O2/c1-2-3-6(8)7(11)9-4-5-10/h6,10H,2-5,8H2,1H3,(H,9,11)/t6-/m0/s1
InChIKeyORDOKJCFCOSGEX-LURJTMIESA-N
MW160.22 g/mol
LogP-0.78
Rot. Bonds5

About (2S)-2-amino-N-(2-hydroxyethyl)pentanamide

(2S)-2-amino-N-(2-hydroxyethyl)pentanamide (PubChem CID 89064333) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is (2S)-2-amino-N-(2-hydroxyethyl)pentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(2-hydroxyethyl)pentanamide
PubChem CID89064333
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC Name(2S)-2-amino-N-(2-hydroxyethyl)pentanamide
SMILESCCC[C@H](N)C(=O)NCCO
InChIInChI=1S/C7H16N2O2/c1-2-3-6(8)7(11)9-4-5-10/h6,10H,2-5,8H2,1H3,(H,9,11)/t6-/m0/s1
InChIKeyORDOKJCFCOSGEX-LURJTMIESA-N
XLogP-0.78
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 5-0.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-propylpentanamide
CID 43649977
(2S)-2-amino-N-(5-hydroxypentyl)pentanamide
CID 107571012
(2R)-2-amino-N-butylpentanamide
CID 82668431
(2S)-2-amino-N-(4-hydroxy-2-methylbutyl)pentanamide
CID 107569995
2-amino-N-[2-(3-hydroxypropylsulfanyl)ethyl]pentanamide
CID 103950544
2-amino-N-(2-hydroxyethyl)-4-methoxybutanamide
CID 62472987
2-amino-N-(3,3-dimethylbutyl)pentanamide
CID 112687728
(2S)-2-amino-N-(2-ethoxyethyl)pentanamide
CID 107568294
2-amino-N-(5-methylhexyl)pentanamide
CID 81433782
(2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide
CID 106235890
2-amino-N-(2,2-dimethoxyethyl)pentanamide
CID 61274915
(2R)-2-amino-N-[2-[di(propan-2-yl)amino]ethyl]pentanamide
CID 103813236

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(2-hydroxyethyl)pentanamide?
The IUPAC name of (2S)-2-amino-N-(2-hydroxyethyl)pentanamide (CID 89064333) is (2S)-2-amino-N-(2-hydroxyethyl)pentanamide.
What is the SMILES notation for (2S)-2-amino-N-(2-hydroxyethyl)pentanamide?
The canonical SMILES for (2S)-2-amino-N-(2-hydroxyethyl)pentanamide is CCC[C@H](N)C(=O)NCCO.
What is the InChIKey of (2S)-2-amino-N-(2-hydroxyethyl)pentanamide?
The InChIKey is ORDOKJCFCOSGEX-LURJTMIESA-N. The full InChI is InChI=1S/C7H16N2O2/c1-2-3-6(8)7(11)9-4-5-10/h6,10H,2-5,8H2,1H3,(H,9,11)/t6-/m0/s1.
What are the key properties of (2S)-2-amino-N-(2-hydroxyethyl)pentanamide?
(2S)-2-amino-N-(2-hydroxyethyl)pentanamide has a molecular weight of 160.22 g/mol, XLogP of -0.78, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(2-hydroxyethyl)pentanamide is sourced from PubChem (CID 89064333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).