(3S)-N-ethyl-3,4-dihydroxybutanamide

C6H13NO3 — CID 11286550

IUPAC(3S)-N-ethyl-3,4-dihydroxybutanamide
SMILESCCNC(=O)C[C@H](O)CO
InChIInChI=1S/C6H13NO3/c1-2-7-6(10)3-5(9)4-8/h5,8-9H,2-4H2,1H3,(H,7,10)/t5-/m0/s1
InChIKeyGUZHWHSNZJZQPY-YFKPBYRVSA-N
MW147.17 g/mol
LogP-1.13
Rot. Bonds4

About (3S)-N-ethyl-3,4-dihydroxybutanamide

(3S)-N-ethyl-3,4-dihydroxybutanamide (PubChem CID 11286550) has the molecular formula C6H13NO3 and a molecular weight of 147.17 g/mol. Its IUPAC name is (3S)-N-ethyl-3,4-dihydroxybutanamide.

Molecular Properties

Compound Name(3S)-N-ethyl-3,4-dihydroxybutanamide
PubChem CID11286550
Molecular FormulaC6H13NO3
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Name(3S)-N-ethyl-3,4-dihydroxybutanamide
SMILESCCNC(=O)C[C@H](O)CO
InChIInChI=1S/C6H13NO3/c1-2-7-6(10)3-5(9)4-8/h5,8-9H,2-4H2,1H3,(H,7,10)/t5-/m0/s1
InChIKeyGUZHWHSNZJZQPY-YFKPBYRVSA-N
XLogP-1.13
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 5-1.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3,4-dihydroxybutanamide
CID 18386927
(3S)-3,4-dihydroxy-N'-propan-2-ylbutanehydrazide
CID 130198455
N,N'-diethylpropanediamide
CID 4600245
N-[(2R)-2,3-dihydroxypropyl]propanamide
CID 88953699
N-benzyl-3,4-dihydroxybutanamide
CID 69242116
(3S)-N-[1-(dimethylamino)ethyl]-3,4-dihydroxybutanamide
CID 87957366
(6S)-6,7-dihydroxyheptane-3,4-dione
CID 58618706
N-(2,3-dihydroxypropyl)butanamide
CID 20700885
N-ethyl-4-hydroxy-3-methylpent-4-enamide
CID 122658995
2-[2-(ethylamino)-2-oxoethyl]-3-methylbut-3-enoic acid
CID 118346927
(5S)-1,2-dihydroxy-5-methylheptan-4-one
CID 168860493
1,2-dihydroxy-5-methylheptan-4-one
CID 168860492

Frequently Asked Questions

What is the IUPAC name of (3S)-N-ethyl-3,4-dihydroxybutanamide?
The IUPAC name of (3S)-N-ethyl-3,4-dihydroxybutanamide (CID 11286550) is (3S)-N-ethyl-3,4-dihydroxybutanamide.
What is the SMILES notation for (3S)-N-ethyl-3,4-dihydroxybutanamide?
The canonical SMILES for (3S)-N-ethyl-3,4-dihydroxybutanamide is CCNC(=O)C[C@H](O)CO.
What is the InChIKey of (3S)-N-ethyl-3,4-dihydroxybutanamide?
The InChIKey is GUZHWHSNZJZQPY-YFKPBYRVSA-N. The full InChI is InChI=1S/C6H13NO3/c1-2-7-6(10)3-5(9)4-8/h5,8-9H,2-4H2,1H3,(H,7,10)/t5-/m0/s1.
What are the key properties of (3S)-N-ethyl-3,4-dihydroxybutanamide?
(3S)-N-ethyl-3,4-dihydroxybutanamide has a molecular weight of 147.17 g/mol, XLogP of -1.13, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-ethyl-3,4-dihydroxybutanamide is sourced from PubChem (CID 11286550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).