N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide

C21H44N2O2 — CID 3049996

IUPACN,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide
SMILESCCCCN(CCCC)CC(O)CCC(=O)N(CCCC)CCCC
InChIInChI=1S/C21H44N2O2/c1-5-9-15-22(16-10-6-2)19-20(24)13-14-21(25)23(17-11-7-3)18-12-8-4/h20,24H,5-19H2,1-4H3
InChIKeyBHCGSYJCVPWLQF-UHFFFAOYSA-N
MW356.60 g/mol
LogP4.46
Rot. Bonds17

About N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide

N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide (PubChem CID 3049996) has the molecular formula C21H44N2O2 and a molecular weight of 356.60 g/mol. Its IUPAC name is N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide.

Molecular Properties

Compound NameN,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide
PubChem CID3049996
Molecular FormulaC21H44N2O2
Molecular Weight356.60 g/mol
Exact Mass356.34
IUPAC NameN,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide
SMILESCCCCN(CCCC)CC(O)CCC(=O)N(CCCC)CCCC
InChIInChI=1S/C21H44N2O2/c1-5-9-15-22(16-10-6-2)19-20(24)13-14-21(25)23(17-11-7-3)18-12-8-4/h20,24H,5-19H2,1-4H3
InChIKeyBHCGSYJCVPWLQF-UHFFFAOYSA-N
XLogP4.46
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds17
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.60
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N,N',N'-tetrakis(2-hydroxypropyl)adipamide
CID 93821
5-Hydroxy-1-methylpiperidin-2-one
CID 58763646
Pentanamide, N,N-dibutyl-5-(dibutylamino)-4-hydroxy-, monohydrochloride
CID 3049995
N,N-Dibutyl-5-(dipropylamino)-4-hydroxypentanamide--hydrogen chloride (1/1)
CID 3049997
4-Hydroxy-5-(piperidin-1-yl)-N,N-dipropylpentanamide--hydrogen chloride (1/1)
CID 3050001
N,N-Diethyl-4-hydroxy-5-(morpholin-4-yl)pentanamide--hydrogen chloride (1/1)
CID 3050005
4-Morpholinepentanamide, N,N-dibutyl-gamma-hydroxy-, monohydrochloride
CID 3050007
N,N-diisopropyl-4-hydroxypentanamide
CID 11206451
N,N-Dihexyl-4-hydroxybutanamide
CID 71407073
N,N-dibutyl-5-(dipropylamino)-4-hydroxypentanamide
CID 3049998
4-hydroxy-5-piperidin-1-yl-N,N-dipropylpentanamide
CID 3050002
N,N-diethyl-4-hydroxy-5-morpholin-4-ylpentanamide
CID 3050006

Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide?
The IUPAC name of N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide (CID 3049996) is N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide.
What is the SMILES notation for N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide?
The canonical SMILES for N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide is CCCCN(CCCC)CC(O)CCC(=O)N(CCCC)CCCC.
What is the InChIKey of N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide?
The InChIKey is BHCGSYJCVPWLQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H44N2O2/c1-5-9-15-22(16-10-6-2)19-20(24)13-14-21(25)23(17-11-7-3)18-12-8-4/h20,24H,5-19H2,1-4H3.
What are the key properties of N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide?
N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide has a molecular weight of 356.60 g/mol, XLogP of 4.46, 17 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-5-(dibutylamino)-4-hydroxypentanamide is sourced from PubChem (CID 3049996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).