4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide

C13H27N3O — CID 107397676

IUPAC4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide
SMILESCCNC(=O)CC(CN)N(CC)CC1CCC1
InChIInChI=1S/C13H27N3O/c1-3-15-13(17)8-12(9-14)16(4-2)10-11-6-5-7-11/h11-12H,3-10,14H2,1-2H3,(H,15,17)
InChIKeyUDTGYARGEUEYBG-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.96
Rot. Bonds8

About 4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide

4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide (PubChem CID 107397676) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide.

Molecular Properties

Compound Name4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide
PubChem CID107397676
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide
SMILESCCNC(=O)CC(CN)N(CC)CC1CCC1
InChIInChI=1S/C13H27N3O/c1-3-15-13(17)8-12(9-14)16(4-2)10-11-6-5-7-11/h11-12H,3-10,14H2,1-2H3,(H,15,17)
InChIKeyUDTGYARGEUEYBG-UHFFFAOYSA-N
XLogP0.96
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-3-[cyclopropylmethyl(ethyl)amino]-N-methylbutanamide
CID 66427576
4-amino-N-cyclopropyl-3-[cyclopropylmethyl(ethyl)amino]butanamide
CID 66432647
4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide
CID 66432868
4-amino-3-[cyclopropylmethyl(ethyl)amino]-1-pyrrolidin-1-ylbutan-1-one
CID 66430078
tert-butyl N-[4-amino-3-[cyclobutylmethyl(ethyl)amino]butyl]carbamate
CID 107397726
4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide
CID 102992088
2-N-(cyclobutylmethyl)-2-N-ethyl-4,4-dimethylpentane-1,2-diamine
CID 107397832
4-amino-3-[ethyl(oxolan-2-ylmethyl)amino]-N-methylbutanamide
CID 66427136
4-amino-3-[butan-2-yl(ethyl)amino]-N-ethylbutanamide
CID 66428428
4-amino-3-[cyclopropylmethyl(methyl)amino]-N-propylbutanamide
CID 66427616
2-[cyclobutylmethyl(ethyl)amino]propanehydrazide
CID 107402367
4-amino-N-cyclopropyl-3-[ethyl(2-methylbutyl)amino]butanamide
CID 79478006

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide?
The IUPAC name of 4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide (CID 107397676) is 4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide.
What is the SMILES notation for 4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide?
The canonical SMILES for 4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide is CCNC(=O)CC(CN)N(CC)CC1CCC1.
What is the InChIKey of 4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide?
The InChIKey is UDTGYARGEUEYBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-3-15-13(17)8-12(9-14)16(4-2)10-11-6-5-7-11/h11-12H,3-10,14H2,1-2H3,(H,15,17).
What are the key properties of 4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide?
4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide has a molecular weight of 241.38 g/mol, XLogP of 0.96, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide is sourced from PubChem (CID 107397676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).