5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide

C12H26N2O2 — CID 82851620

IUPAC5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide
SMILESCCCCN(CCO)C(=O)CCCC(C)N
InChIInChI=1S/C12H26N2O2/c1-3-4-8-14(9-10-15)12(16)7-5-6-11(2)13/h11,15H,3-10,13H2,1-2H3
InChIKeyABHYQQMUZXWALN-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.12
Rot. Bonds9

About 5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide

5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide (PubChem CID 82851620) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide.

Molecular Properties

Compound Name5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide
PubChem CID82851620
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide
SMILESCCCCN(CCO)C(=O)CCCC(C)N
InChIInChI=1S/C12H26N2O2/c1-3-4-8-14(9-10-15)12(16)7-5-6-11(2)13/h11,15H,3-10,13H2,1-2H3
InChIKeyABHYQQMUZXWALN-UHFFFAOYSA-N
XLogP1.12
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N-butyl-N-ethylhexanamide
CID 82848623
3-amino-N-hexyl-N-(2-hydroxyethyl)butanamide
CID 60963416
5-amino-N,N-diethylhexanamide
CID 82848451
N-(3-aminopropyl)-N-(2-hydroxyethyl)octanamide
CID 135358896
5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide
CID 82851354
3-amino-N-hexyl-N-(2-hydroxyethyl)propanamide
CID 60962564
N,N-bis(2-hydroxyethyl)-7-methyloctanamide
CID 54230939
N,N-bis(2-hydroxyethyl)butanamide
CID 14455174
5-[hexadecyl(2-hydroxyethyl)amino]-5-oxopentanoic acid
CID 4249271
5-[dodecyl(2-hydroxyethyl)amino]-5-oxopentanoic acid
CID 3327621
N,N-bis(3-hydroxypropyl)icosanamide
CID 102118836
N-butyl-N-octyldecanamide
CID 18913402

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide?
The IUPAC name of 5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide (CID 82851620) is 5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide.
What is the SMILES notation for 5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide?
The canonical SMILES for 5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide is CCCCN(CCO)C(=O)CCCC(C)N.
What is the InChIKey of 5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide?
The InChIKey is ABHYQQMUZXWALN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-3-4-8-14(9-10-15)12(16)7-5-6-11(2)13/h11,15H,3-10,13H2,1-2H3.
What are the key properties of 5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide?
5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide has a molecular weight of 230.35 g/mol, XLogP of 1.12, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide is sourced from PubChem (CID 82851620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).