(4S)-4-amino-N-ethyl-5-hydroxypentanamide

C7H16N2O2 — CID 57301877

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

About (4S)-4-amino-N-ethyl-5-hydroxypentanamide

(4S)-4-amino-N-ethyl-5-hydroxypentanamide (PubChem CID 57301877) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is (4S)-4-amino-N-ethyl-5-hydroxypentanamide.

Molecular Properties

Compound Name(4S)-4-amino-N-ethyl-5-hydroxypentanamide
PubChem CID57301877
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC Name(4S)-4-amino-N-ethyl-5-hydroxypentanamide
SMILESCCNC(=O)CC[C@H](N)CO
InChIInChI=1S/C7H16N2O2/c1-2-9-7(11)4-3-6(8)5-10/h6,10H,2-5,8H2,1H3,(H,9,11)/t6-/m0/s1
InChIKeyDXYALMCAFIVJMY-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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Frequently Asked Questions

What is the IUPAC name of (4S)-4-amino-N-ethyl-5-hydroxypentanamide?
The IUPAC name of (4S)-4-amino-N-ethyl-5-hydroxypentanamide (CID 57301877) is (4S)-4-amino-N-ethyl-5-hydroxypentanamide.
What is the SMILES notation for (4S)-4-amino-N-ethyl-5-hydroxypentanamide?
The canonical SMILES for (4S)-4-amino-N-ethyl-5-hydroxypentanamide is CCNC(=O)CC[C@H](N)CO.
What is the InChIKey of (4S)-4-amino-N-ethyl-5-hydroxypentanamide?
The InChIKey is DXYALMCAFIVJMY-LURJTMIESA-N. The full InChI is InChI=1S/C7H16N2O2/c1-2-9-7(11)4-3-6(8)5-10/h6,10H,2-5,8H2,1H3,(H,9,11)/t6-/m0/s1.
What are the key properties of (4S)-4-amino-N-ethyl-5-hydroxypentanamide?
(4S)-4-amino-N-ethyl-5-hydroxypentanamide 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 (4S)-4-amino-N-ethyl-5-hydroxypentanamide is sourced from PubChem (CID 57301877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).