2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone

C10H15N3O — CID 116605038

IUPAC2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone
SMILESCn1cc(C(N)C(=O)C2CCC2)cn1
InChIInChI=1S/C10H15N3O/c1-13-6-8(5-12-13)9(11)10(14)7-3-2-4-7/h5-7,9H,2-4,11H2,1H3
InChIKeyJSVYVCPURJZENZ-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.79
Rot. Bonds3

About 2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone

2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone (PubChem CID 116605038) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone.

Molecular Properties

Compound Name2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone
PubChem CID116605038
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone
SMILESCn1cc(C(N)C(=O)C2CCC2)cn1
InChIInChI=1S/C10H15N3O/c1-13-6-8(5-12-13)9(11)10(14)7-3-2-4-7/h5-7,9H,2-4,11H2,1H3
InChIKeyJSVYVCPURJZENZ-UHFFFAOYSA-N
XLogP0.79
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone 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

(3S)-1-[2-amino-2-(1-methylpyrazol-4-yl)acetyl]piperidine-3-carboxylic acid
CID 115291008
cyclopropylmethyl 2-amino-2-(1-methylpyrazol-4-yl)acetate
CID 115288981
2-amino-N-cyclopentyl-N-(2-methylpropyl)-2-(1-methylpyrazol-4-yl)acetamide
CID 115290971
2-amino-1-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]-2-(1-methylpyrazol-4-yl)ethanone
CID 107220716
2-amino-1-(4-methylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 115289498
ethyl (2S)-2-amino-2-(1-methylpyrazol-4-yl)acetate
CID 93311142
propan-2-yl 2-amino-2-(1-methylpyrazol-4-yl)acetate
CID 115288979
2-amino-N-cyclopropyl-N-ethyl-2-(1-methylpyrazol-4-yl)acetamide
CID 115289735
2-amino-1-(4-cyclopropyloxyphenyl)-2-(1-methylpyrazol-4-yl)ethanone
CID 114520707
2-amino-1-(4-tert-butylpiperidin-1-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 115290579
(3,4-dimethylcyclohexyl) 2-amino-2-(1-methylpyrazol-4-yl)acetate
CID 115289019
2-amino-1-(4-chloro-1-methylpyrazol-5-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 114670883

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone?
The IUPAC name of 2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone (CID 116605038) is 2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone.
What is the SMILES notation for 2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone?
The canonical SMILES for 2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone is Cn1cc(C(N)C(=O)C2CCC2)cn1.
What is the InChIKey of 2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone?
The InChIKey is JSVYVCPURJZENZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-13-6-8(5-12-13)9(11)10(14)7-3-2-4-7/h5-7,9H,2-4,11H2,1H3.
What are the key properties of 2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone?
2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone has a molecular weight of 193.25 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-cyclobutyl-2-(1-methylpyrazol-4-yl)ethanone is sourced from PubChem (CID 116605038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).