methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate

C10H14N2O3 — CID 146278831

IUPACmethyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate
SMILESCOC(=O)c1cc(OCC2CC2)nn1C
InChIInChI=1S/C10H14N2O3/c1-12-8(10(13)14-2)5-9(11-12)15-6-7-3-4-7/h5,7H,3-4,6H2,1-2H3
InChIKeyRGJVVYXQFAPUTE-UHFFFAOYSA-N
MW210.23 g/mol
LogP1.00
Rot. Bonds4

About methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate

methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate (PubChem CID 146278831) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate.

Molecular Properties

Compound Namemethyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate
PubChem CID146278831
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Namemethyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate
SMILESCOC(=O)c1cc(OCC2CC2)nn1C
InChIInChI=1S/C10H14N2O3/c1-12-8(10(13)14-2)5-9(11-12)15-6-7-3-4-7/h5,7H,3-4,6H2,1-2H3
InChIKeyRGJVVYXQFAPUTE-UHFFFAOYSA-N
XLogP1.00
TPSA53.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 51.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate 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

methyl 4-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylate
CID 67057251
methyl 1-methyl-3-[[4-[[2-(trifluoromethyl)phenoxy]methyl]piperidine-1-carbonyl]amino]pyrazole-5-carboxylate
CID 166273049
methyl 1-methyl-3-propan-2-ylpyrazole-5-carboxylate
CID 25248219
sodium 2,2-difluoro-2-(5-methoxycarbonyl-1-methylpyrazol-3-yl)oxyacetate
CID 156696153
methyl 1-methyl-3-(2-oxoethyl)pyrazole-5-carboxylate
CID 164718842
N-[(4-hydroxycyclohexyl)methyl]-2,5-dimethylpyrazole-3-carboxamide
CID 106121963
methyl 3-cyclohexa-2,4-dien-1-yl-1-methylpyrazole-5-carboxylate
CID 143614842
N-ethyl-1-methyl-3-propoxypyrazole-5-carboxamide
CID 176998259
3-O-benzyl 5-O-methyl 1-methylpyrazole-3,5-dicarboxylate
CID 10956696
methyl 3-[(4-hydroxycyclohexyl)methoxy]-4-methylthiophene-2-carboxylate
CID 167925614
methyl 3-(cyclopropylmethoxy)-4-ethylbenzoate
CID 123922954
1-methyl-N-propan-2-yl-3-propoxypyrazole-5-carboxamide
CID 176998192

Frequently Asked Questions

What is the IUPAC name of methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate?
The IUPAC name of methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate (CID 146278831) is methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate.
What is the SMILES notation for methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate?
The canonical SMILES for methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate is COC(=O)c1cc(OCC2CC2)nn1C.
What is the InChIKey of methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate?
The InChIKey is RGJVVYXQFAPUTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-12-8(10(13)14-2)5-9(11-12)15-6-7-3-4-7/h5,7H,3-4,6H2,1-2H3.
What are the key properties of methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate?
methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate has a molecular weight of 210.23 g/mol, XLogP of 1.00, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate is sourced from PubChem (CID 146278831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).