N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide

C10H22N2O2 — CID 79191572

IUPACN-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide
SMILESCN(C)CCCN(C)C(=O)CCCO
InChIInChI=1S/C10H22N2O2/c1-11(2)7-5-8-12(3)10(14)6-4-9-13/h13H,4-9H2,1-3H3
InChIKeyGUQRAQZXKIGIOP-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.17
Rot. Bonds7

About N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide

N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide (PubChem CID 79191572) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide
PubChem CID79191572
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC NameN-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide
SMILESCN(C)CCCN(C)C(=O)CCCO
InChIInChI=1S/C10H22N2O2/c1-11(2)7-5-8-12(3)10(14)6-4-9-13/h13H,4-9H2,1-3H3
InChIKeyGUQRAQZXKIGIOP-UHFFFAOYSA-N
XLogP0.17
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide (CID 79191572) is N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide is CN(C)CCCN(C)C(=O)CCCO.
What is the InChIKey of N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide?
The InChIKey is GUQRAQZXKIGIOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-11(2)7-5-8-12(3)10(14)6-4-9-13/h13H,4-9H2,1-3H3.
What are the key properties of N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide?
N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide has a molecular weight of 202.30 g/mol, XLogP of 0.17, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide is sourced from PubChem (CID 79191572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).