4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide

C13H29N3O — CID 103814940

IUPAC4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide
SMILESCCCN(CC)CCNC(=O)CCC(C)(C)N
InChIInChI=1S/C13H29N3O/c1-5-10-16(6-2)11-9-15-12(17)7-8-13(3,4)14/h5-11,14H2,1-4H3,(H,15,17)
InChIKeyRWODVILMBAAFGJ-UHFFFAOYSA-N
MW243.39 g/mol
LogP1.35
Rot. Bonds9

About 4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide

4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide (PubChem CID 103814940) has the molecular formula C13H29N3O and a molecular weight of 243.39 g/mol. Its IUPAC name is 4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide.

Molecular Properties

Compound Name4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide
PubChem CID103814940
Molecular FormulaC13H29N3O
Molecular Weight243.39 g/mol
Exact Mass243.23
IUPAC Name4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide
SMILESCCCN(CC)CCNC(=O)CCC(C)(C)N
InChIInChI=1S/C13H29N3O/c1-5-10-16(6-2)11-9-15-12(17)7-8-13(3,4)14/h5-11,14H2,1-4H3,(H,15,17)
InChIKeyRWODVILMBAAFGJ-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[2-[ethyl(propyl)amino]ethyl]-3-methylbutanamide
CID 103814926
N-[2-(diethylamino)ethyl]-4,4-dimethylpentanamide
CID 59170011
ethyl 4-[2-[ethyl(propyl)amino]ethylamino]-4-oxobutanoate
CID 113247689
ethyl 2-[2-[ethyl(propyl)amino]ethylcarbamoyl]-3,3-dimethylbutanoate
CID 104917991
4-amino-N-(2-ethylsulfonylethyl)-4-methylpentanamide
CID 103810364
2-cyano-N-[2-[ethyl(propyl)amino]ethyl]acetamide
CID 104919958
N-[2-[ethyl(propyl)amino]ethyl]-2,2-difluoroacetamide
CID 107168084
2-(carbamoylamino)-N-[2-(diethylamino)ethyl]acetamide
CID 127518867
4-amino-N-[2-(diethylamino)-2-oxoethyl]-4-methylpentanamide
CID 112701724
2-amino-N-[2-[ethyl(propyl)amino]ethyl]-2-phenylpropanamide;dihydrochloride
CID 120597323
N-[2-[2-(butanoylamino)ethyl-propylamino]ethyl]pentanamide
CID 156706251
4-amino-N-(2-hydroxyethyl)-4-methylpentanamide;oxalic acid
CID 88516953

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide?
The IUPAC name of 4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide (CID 103814940) is 4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide.
What is the SMILES notation for 4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide?
The canonical SMILES for 4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide is CCCN(CC)CCNC(=O)CCC(C)(C)N.
What is the InChIKey of 4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide?
The InChIKey is RWODVILMBAAFGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O/c1-5-10-16(6-2)11-9-15-12(17)7-8-13(3,4)14/h5-11,14H2,1-4H3,(H,15,17).
What are the key properties of 4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide?
4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide has a molecular weight of 243.39 g/mol, XLogP of 1.35, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-[ethyl(propyl)amino]ethyl]-4-methylpentanamide is sourced from PubChem (CID 103814940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).