N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide

C8H18N2O2 — CID 79002121

IUPACN-[2-(dimethylamino)ethyl]-4-hydroxybutanamide
SMILESCN(C)CCNC(=O)CCCO
InChIInChI=1S/C8H18N2O2/c1-10(2)6-5-9-8(12)4-3-7-11/h11H,3-7H2,1-2H3,(H,9,12)
InChIKeyVXEXYDFPJNWYRG-UHFFFAOYSA-N
MW174.24 g/mol
LogP-0.56
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide

N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide (PubChem CID 79002121) has the molecular formula C8H18N2O2 and a molecular weight of 174.24 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-4-hydroxybutanamide
PubChem CID79002121
Molecular FormulaC8H18N2O2
Molecular Weight174.24 g/mol
Exact Mass174.14
IUPAC NameN-[2-(dimethylamino)ethyl]-4-hydroxybutanamide
SMILESCN(C)CCNC(=O)CCCO
InChIInChI=1S/C8H18N2O2/c1-10(2)6-5-9-8(12)4-3-7-11/h11H,3-7H2,1-2H3,(H,9,12)
InChIKeyVXEXYDFPJNWYRG-UHFFFAOYSA-N
XLogP-0.56
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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

N-[2-(dimethylamino)ethyl]-4-(methylamino)butanamide
CID 60841312
10-[2-(dimethylamino)ethylamino]-10-oxodecanoic acid
CID 51038800
4-hydroxy-N-[2-(4-hydroxybutanoylamino)ethyl]butanamide
CID 95562402
3-[3-[bis[3-[bis[3-[2-(dimethylamino)ethylamino]-3-oxopropyl]amino]propyl]amino]propyl-[3-[2-(dimethylamino)ethylamino]-3-oxopropyl]amino]-N-[2-(dimethylamino)ethyl]propanamide
CID 167166577
4-hydroxy-N-[4-(4-hydroxybutanoylamino)butyl]butanamide
CID 6611551
N'-[3-(dimethylamino)propyl]hexanediamide
CID 174324158
N-[2-(dimethylamino)ethyl]pent-4-enamide
CID 158602518
N-[3-(dimethylamino)propyl]nonanamide
CID 3395805
10-[3-(dimethylamino)propylamino]-10-oxodecanoic acid
CID 51038580
(E)-N-[2-(dimethylamino)ethyl]non-4-enamide
CID 102117820
4-(dimethylamino)-N-(3-sulfanylpropyl)butanamide
CID 23187599
(E)-N-[2-(dimethylamino)ethyl]oct-4-enamide
CID 102117814

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide (CID 79002121) is N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide is CN(C)CCNC(=O)CCCO.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide?
The InChIKey is VXEXYDFPJNWYRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2/c1-10(2)6-5-9-8(12)4-3-7-11/h11H,3-7H2,1-2H3,(H,9,12).
What are the key properties of N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide?
N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide has a molecular weight of 174.24 g/mol, XLogP of -0.56, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide is sourced from PubChem (CID 79002121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).