4-(dimethylamino)-N-ethyl-3-hydroxybutanamide

C8H18N2O2 — CID 153398996

IUPAC4-(dimethylamino)-N-ethyl-3-hydroxybutanamide
SMILESCCNC(=O)CC(O)CN(C)C
InChIInChI=1S/C8H18N2O2/c1-4-9-8(12)5-7(11)6-10(2)3/h7,11H,4-6H2,1-3H3,(H,9,12)
InChIKeyRPXUOLCLTYXURS-UHFFFAOYSA-N
MW174.24 g/mol
LogP-0.56
Rot. Bonds5

About 4-(dimethylamino)-N-ethyl-3-hydroxybutanamide

4-(dimethylamino)-N-ethyl-3-hydroxybutanamide (PubChem CID 153398996) has the molecular formula C8H18N2O2 and a molecular weight of 174.24 g/mol. Its IUPAC name is 4-(dimethylamino)-N-ethyl-3-hydroxybutanamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-ethyl-3-hydroxybutanamide
PubChem CID153398996
Molecular FormulaC8H18N2O2
Molecular Weight174.24 g/mol
Exact Mass174.14
IUPAC Name4-(dimethylamino)-N-ethyl-3-hydroxybutanamide
SMILESCCNC(=O)CC(O)CN(C)C
InChIInChI=1S/C8H18N2O2/c1-4-9-8(12)5-7(11)6-10(2)3/h7,11H,4-6H2,1-3H3,(H,9,12)
InChIKeyRPXUOLCLTYXURS-UHFFFAOYSA-N
XLogP-0.56
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 5-0.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dihydroxy-N,N'-bis(2-hydroxyethyl)butanediamide
CID 590477
4-amino-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium chloride
CID 13455332
2,3-Dihydroxy-N(1),N(4)-dipentylsuccinamide
CID 226282
N-ethyl-3-hydroxybutanamide
CID 14195430
(R)-carnitinamide
CID 11701090
(2~{R},3~{R})-2,3-bis(oxidanyl)-~{N},~{N}'-dipropyl-butanediamide
CID 13226340
Carnitinamide chloride
CID 24771800
N,N'-Di-n-butyl L-tartaramide
CID 2301708
1-[(2S)-2-hydroxy-3-(methylamino)propyl]pyrrolidin-2-one
CID 28408742
(2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide
CID 10177016
(2S,3S)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide
CID 13215104
n-Ethylmalamide
CID 53971596

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-ethyl-3-hydroxybutanamide?
The IUPAC name of 4-(dimethylamino)-N-ethyl-3-hydroxybutanamide (CID 153398996) is 4-(dimethylamino)-N-ethyl-3-hydroxybutanamide.
What is the SMILES notation for 4-(dimethylamino)-N-ethyl-3-hydroxybutanamide?
The canonical SMILES for 4-(dimethylamino)-N-ethyl-3-hydroxybutanamide is CCNC(=O)CC(O)CN(C)C.
What is the InChIKey of 4-(dimethylamino)-N-ethyl-3-hydroxybutanamide?
The InChIKey is RPXUOLCLTYXURS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2/c1-4-9-8(12)5-7(11)6-10(2)3/h7,11H,4-6H2,1-3H3,(H,9,12).
What are the key properties of 4-(dimethylamino)-N-ethyl-3-hydroxybutanamide?
4-(dimethylamino)-N-ethyl-3-hydroxybutanamide has a molecular weight of 174.24 g/mol, XLogP of -0.56, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-ethyl-3-hydroxybutanamide is sourced from PubChem (CID 153398996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).