4-amino-N-cyclobutyl-3-methylbutanamide

C9H18N2O — CID 81086885

IUPAC4-amino-N-cyclobutyl-3-methylbutanamide
SMILESCC(CN)CC(=O)NC1CCC1
InChIInChI=1S/C9H18N2O/c1-7(6-10)5-9(12)11-8-3-2-4-8/h7-8H,2-6,10H2,1H3,(H,11,12)
InChIKeyYCTPAHNFIPIEOB-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.64
Rot. Bonds4

About 4-amino-N-cyclobutyl-3-methylbutanamide

4-amino-N-cyclobutyl-3-methylbutanamide (PubChem CID 81086885) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 4-amino-N-cyclobutyl-3-methylbutanamide.

Molecular Properties

Compound Name4-amino-N-cyclobutyl-3-methylbutanamide
PubChem CID81086885
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name4-amino-N-cyclobutyl-3-methylbutanamide
SMILESCC(CN)CC(=O)NC1CCC1
InChIInChI=1S/C9H18N2O/c1-7(6-10)5-9(12)11-8-3-2-4-8/h7-8H,2-6,10H2,1H3,(H,11,12)
InChIKeyYCTPAHNFIPIEOB-UHFFFAOYSA-N
XLogP0.64
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-cyclohexyl-3-methylbutanamide
CID 81070976
4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide
CID 81071155
4-amino-3-methyl-N-[3-(trifluoromethyl)cyclohexyl]butanamide
CID 81076103
5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid
CID 62965613
(3S)-3-amino-N-cyclobutylbutanamide
CID 94423965
4-amino-3-methyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]butanamide
CID 81075421
N-cyclopropyl-3-methylhexanamide
CID 155359047
1-(3-amino-2-methylpropyl)-3-cyclobutylurea
CID 116658132
4-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-methylbutanamide
CID 81076250
N-cyclohexyl-3-methylbutanamide;methane
CID 161464891
5-amino-N-(3-hydroxycyclohexyl)-4-methylpentanamide
CID 82012457
4-amino-3-methyl-N-[2-(trifluoromethyl)cyclohexyl]butanamide
CID 81076180

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclobutyl-3-methylbutanamide?
The IUPAC name of 4-amino-N-cyclobutyl-3-methylbutanamide (CID 81086885) is 4-amino-N-cyclobutyl-3-methylbutanamide.
What is the SMILES notation for 4-amino-N-cyclobutyl-3-methylbutanamide?
The canonical SMILES for 4-amino-N-cyclobutyl-3-methylbutanamide is CC(CN)CC(=O)NC1CCC1.
What is the InChIKey of 4-amino-N-cyclobutyl-3-methylbutanamide?
The InChIKey is YCTPAHNFIPIEOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7(6-10)5-9(12)11-8-3-2-4-8/h7-8H,2-6,10H2,1H3,(H,11,12).
What are the key properties of 4-amino-N-cyclobutyl-3-methylbutanamide?
4-amino-N-cyclobutyl-3-methylbutanamide has a molecular weight of 170.26 g/mol, XLogP of 0.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclobutyl-3-methylbutanamide is sourced from PubChem (CID 81086885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).