5-(cyclobutylmethylamino)-5-oxopentanoic acid

C10H17NO3 — CID 43529068

IUPAC5-(cyclobutylmethylamino)-5-oxopentanoic acid
SMILESO=C(O)CCCC(=O)NCC1CCC1
InChIInChI=1S/C10H17NO3/c12-9(5-2-6-10(13)14)11-7-8-3-1-4-8/h8H,1-7H2,(H,11,12)(H,13,14)
InChIKeyGWMLAQOMVHMRKX-UHFFFAOYSA-N
MW199.25 g/mol
LogP1.16
Rot. Bonds6

About 5-(cyclobutylmethylamino)-5-oxopentanoic acid

5-(cyclobutylmethylamino)-5-oxopentanoic acid (PubChem CID 43529068) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is 5-(cyclobutylmethylamino)-5-oxopentanoic acid.

Molecular Properties

Compound Name5-(cyclobutylmethylamino)-5-oxopentanoic acid
PubChem CID43529068
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name5-(cyclobutylmethylamino)-5-oxopentanoic acid
SMILESO=C(O)CCCC(=O)NCC1CCC1
InChIInChI=1S/C10H17NO3/c12-9(5-2-6-10(13)14)11-7-8-3-1-4-8/h8H,1-7H2,(H,11,12)(H,13,14)
InChIKeyGWMLAQOMVHMRKX-UHFFFAOYSA-N
XLogP1.16
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
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

Analyze 5-(cyclobutylmethylamino)-5-oxopentanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[(4-methylcyclohexyl)methylamino]-5-oxopentanoic acid
CID 63243932
5-(cyclopentylmethylcarbamoylamino)-5-oxopentanoic acid
CID 43371300
4-amino-N-(cyclobutylmethyl)butanamide
CID 43298749
5-bromo-N-(cyclobutylmethyl)pentanamide
CID 107907993
5-[[(3S)-1-cyclopentylpiperidin-3-yl]methylamino]-5-oxopentanoic acid
CID 125441266
4-amino-N-(cyclopentylmethyl)butanamide
CID 43371168
3-(cyclopentylmethylamino)-3-oxopropanoic acid
CID 62232432
3-[[3-(cyclohexylmethylamino)-3-oxopropyl]-methylamino]propanoic acid
CID 119911752
5-[(1-cyclopentylpyrrolidin-3-yl)methylamino]-5-oxopentanoic acid
CID 121494274
20-[(4-ethynylcyclohexyl)methylamino]-20-oxoicosanoic acid
CID 163439528
N-(cyclopentylmethyl)-11-sulfanylundecanamide
CID 59137895
6-oxo-6-(oxolan-3-ylmethylamino)hexanoic acid
CID 60919659

Frequently Asked Questions

What is the IUPAC name of 5-(cyclobutylmethylamino)-5-oxopentanoic acid?
The IUPAC name of 5-(cyclobutylmethylamino)-5-oxopentanoic acid (CID 43529068) is 5-(cyclobutylmethylamino)-5-oxopentanoic acid.
What is the SMILES notation for 5-(cyclobutylmethylamino)-5-oxopentanoic acid?
The canonical SMILES for 5-(cyclobutylmethylamino)-5-oxopentanoic acid is O=C(O)CCCC(=O)NCC1CCC1.
What is the InChIKey of 5-(cyclobutylmethylamino)-5-oxopentanoic acid?
The InChIKey is GWMLAQOMVHMRKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3/c12-9(5-2-6-10(13)14)11-7-8-3-1-4-8/h8H,1-7H2,(H,11,12)(H,13,14).
What are the key properties of 5-(cyclobutylmethylamino)-5-oxopentanoic acid?
5-(cyclobutylmethylamino)-5-oxopentanoic acid has a molecular weight of 199.25 g/mol, XLogP of 1.16, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclobutylmethylamino)-5-oxopentanoic acid is sourced from PubChem (CID 43529068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).