5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid

C10H17NO3 — CID 62965613

IUPAC5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid
SMILESCC(CC(=O)O)CC(=O)NC1CCC1
InChIInChI=1S/C10H17NO3/c1-7(6-10(13)14)5-9(12)11-8-3-2-4-8/h7-8H,2-6H2,1H3,(H,11,12)(H,13,14)
InChIKeySNEALEUYZPZFLY-UHFFFAOYSA-N
MW199.25 g/mol
LogP1.16
Rot. Bonds5

About 5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid

5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid (PubChem CID 62965613) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is 5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid.

Molecular Properties

Compound Name5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid
PubChem CID62965613
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid
SMILESCC(CC(=O)O)CC(=O)NC1CCC1
InChIInChI=1S/C10H17NO3/c1-7(6-10(13)14)5-9(12)11-8-3-2-4-8/h7-8H,2-6H2,1H3,(H,11,12)(H,13,14)
InChIKeySNEALEUYZPZFLY-UHFFFAOYSA-N
XLogP1.16
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-cyclobutyl-3-methylbutanamide
CID 81086885
5-[(1-ethylpiperidin-4-yl)amino]-3-methyl-5-oxopentanoic acid
CID 62963713
(3S)-3-amino-N-cyclobutylbutanamide
CID 94423965
4-amino-N-cyclohexyl-3-methylbutanamide
CID 81070976
5-[[(1S,2S)-2-hydroxycyclohexyl]amino]-3-methyl-5-oxopentanoic acid
CID 107214806
5-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-3-methyl-5-oxopentanoic acid
CID 62963865
5-[(2-cyanocyclopentyl)amino]-3-methyl-5-oxopentanoic acid
CID 62961989
4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide
CID 81071155
3-(3-methylpentanoylamino)cyclohexane-1-carboxylic acid
CID 114873705
N-cyclohexyl-3-methylbutanamide;methane
CID 161464891
5-[(2,2-dimethylcyclopropyl)amino]-3-methyl-5-oxopentanoic acid
CID 62964927
N-cyclopropyl-3-methylhexanamide
CID 155359047

Frequently Asked Questions

What is the IUPAC name of 5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid?
The IUPAC name of 5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid (CID 62965613) is 5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid.
What is the SMILES notation for 5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid?
The canonical SMILES for 5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid is CC(CC(=O)O)CC(=O)NC1CCC1.
What is the InChIKey of 5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid?
The InChIKey is SNEALEUYZPZFLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3/c1-7(6-10(13)14)5-9(12)11-8-3-2-4-8/h7-8H,2-6H2,1H3,(H,11,12)(H,13,14).
What are the key properties of 5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid?
5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid has a molecular weight of 199.25 g/mol, XLogP of 1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid is sourced from PubChem (CID 62965613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).