(3R)-N,N-diethyl-3-hydroxybutanamide

C8H17NO2 — CID 11542825

IUPAC(3R)-N,N-diethyl-3-hydroxybutanamide
SMILESCCN(CC)C(=O)C[C@@H](C)O
InChIInChI=1S/C8H17NO2/c1-4-9(5-2)8(11)6-7(3)10/h7,10H,4-6H2,1-3H3/t7-/m1/s1
InChIKeyKEMFIWCUWVHWDK-SSDOTTSWSA-N
MW159.23 g/mol
LogP0.63
Rot. Bonds4

About (3R)-N,N-diethyl-3-hydroxybutanamide

(3R)-N,N-diethyl-3-hydroxybutanamide (PubChem CID 11542825) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is (3R)-N,N-diethyl-3-hydroxybutanamide.

Molecular Properties

Compound Name(3R)-N,N-diethyl-3-hydroxybutanamide
PubChem CID11542825
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name(3R)-N,N-diethyl-3-hydroxybutanamide
SMILESCCN(CC)C(=O)C[C@@H](C)O
InChIInChI=1S/C8H17NO2/c1-4-9(5-2)8(11)6-7(3)10/h7,10H,4-6H2,1-3H3/t7-/m1/s1
InChIKeyKEMFIWCUWVHWDK-SSDOTTSWSA-N
XLogP0.63
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethyl-2-[2-hydroxypropyl(methyl)amino]acetamide
CID 62332611
methyl 4-(diethylamino)-2-methyl-4-oxobutanoate
CID 66561990
4-(diethylamino)-2-ethyl-4-oxobutanoic acid
CID 112515205
3-(aminomethyl)-N,N-diethyl-5-methylhexanamide
CID 25143769
3-(2,2-dimethylpropanoyl)-N,N-diethyl-5,5-dimethyl-4-oxohexanamide
CID 91568368
4-amino-3-[butan-2-yl(ethyl)amino]-N,N-diethylbutanamide
CID 66431882
N,N-diethyl-2-(3-hydroxybutan-2-ylsulfanyl)acetamide
CID 103706039
3-hydroxy-N-methoxy-N-methylbutanamide
CID 73159357
N',N'-diethyl-2-(methylamino)butanediamide
CID 12695982
N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-methylbutanamide
CID 79387562
4-amino-N,N-diethyl-3-[2-methylpropyl(propan-2-yl)amino]butanamide
CID 66431686
3-(1-cyanopropan-2-ylamino)-N,N-diethylbutanamide
CID 104586919

Frequently Asked Questions

What is the IUPAC name of (3R)-N,N-diethyl-3-hydroxybutanamide?
The IUPAC name of (3R)-N,N-diethyl-3-hydroxybutanamide (CID 11542825) is (3R)-N,N-diethyl-3-hydroxybutanamide.
What is the SMILES notation for (3R)-N,N-diethyl-3-hydroxybutanamide?
The canonical SMILES for (3R)-N,N-diethyl-3-hydroxybutanamide is CCN(CC)C(=O)C[C@@H](C)O.
What is the InChIKey of (3R)-N,N-diethyl-3-hydroxybutanamide?
The InChIKey is KEMFIWCUWVHWDK-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H17NO2/c1-4-9(5-2)8(11)6-7(3)10/h7,10H,4-6H2,1-3H3/t7-/m1/s1.
What are the key properties of (3R)-N,N-diethyl-3-hydroxybutanamide?
(3R)-N,N-diethyl-3-hydroxybutanamide has a molecular weight of 159.23 g/mol, XLogP of 0.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N,N-diethyl-3-hydroxybutanamide is sourced from PubChem (CID 11542825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).