N-(3-aminobutyl)-3-ethylpentanamide

C11H24N2O — CID 119496661

IUPACN-(3-aminobutyl)-3-ethylpentanamide
SMILESCCC(CC)CC(=O)NCCC(C)N
InChIInChI=1S/C11H24N2O/c1-4-10(5-2)8-11(14)13-7-6-9(3)12/h9-10H,4-8,12H2,1-3H3,(H,13,14)
InChIKeyCNZPSOKADDZOPM-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.67
Rot. Bonds7

About N-(3-aminobutyl)-3-ethylpentanamide

N-(3-aminobutyl)-3-ethylpentanamide (PubChem CID 119496661) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is N-(3-aminobutyl)-3-ethylpentanamide.

Molecular Properties

Compound NameN-(3-aminobutyl)-3-ethylpentanamide
PubChem CID119496661
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC NameN-(3-aminobutyl)-3-ethylpentanamide
SMILESCCC(CC)CC(=O)NCCC(C)N
InChIInChI=1S/C11H24N2O/c1-4-10(5-2)8-11(14)13-7-6-9(3)12/h9-10H,4-8,12H2,1-3H3,(H,13,14)
InChIKeyCNZPSOKADDZOPM-UHFFFAOYSA-N
XLogP1.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-aminobutyl)-3-benzyl-4-phenylbutanamide;hydrochloride
CID 119497857
N-(3-aminobutyl)-3,5,5-trimethylhexanamide
CID 63253495
N-(3-aminobutyl)-2-(diethylamino)acetamide;dihydrochloride
CID 119495228
N-(3-aminobutyl)-3-phenylbutanamide
CID 119496736
4-[3-(aminomethyl)pentanoylamino]-2-hydroxybutanoic acid
CID 107836045
(4R)-4-amino-N-propylpentanamide
CID 146234117
3-(aminomethyl)-N-(7-methyloctyl)pentanamide
CID 81086572
N-(3-aminobutyl)-3-(4-ethylphenyl)butanamide;hydrochloride
CID 119495877
3-(aminomethyl)-N-(5-hydroxy-4-methylpentyl)pentanamide
CID 106161224
N-(2-aminoethyl)-3-ethyloctanamide
CID 88999094
3-(aminomethyl)-N-(2-ethoxyethyl)pentanamide
CID 81071498
3-(aminomethyl)-N-[2-(carbamoylamino)ethyl]pentanamide
CID 83110778

Frequently Asked Questions

What is the IUPAC name of N-(3-aminobutyl)-3-ethylpentanamide?
The IUPAC name of N-(3-aminobutyl)-3-ethylpentanamide (CID 119496661) is N-(3-aminobutyl)-3-ethylpentanamide.
What is the SMILES notation for N-(3-aminobutyl)-3-ethylpentanamide?
The canonical SMILES for N-(3-aminobutyl)-3-ethylpentanamide is CCC(CC)CC(=O)NCCC(C)N.
What is the InChIKey of N-(3-aminobutyl)-3-ethylpentanamide?
The InChIKey is CNZPSOKADDZOPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-4-10(5-2)8-11(14)13-7-6-9(3)12/h9-10H,4-8,12H2,1-3H3,(H,13,14).
What are the key properties of N-(3-aminobutyl)-3-ethylpentanamide?
N-(3-aminobutyl)-3-ethylpentanamide has a molecular weight of 200.33 g/mol, XLogP of 1.67, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminobutyl)-3-ethylpentanamide is sourced from PubChem (CID 119496661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).