(4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone

C10H14N2O2 — CID 114640859

IUPAC(4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone
SMILESCOc1cnn(C)c1C(=O)C1CC1C
InChIInChI=1S/C10H14N2O2/c1-6-4-7(6)10(13)9-8(14-3)5-11-12(9)2/h5-7H,4H2,1-3H3
InChIKeyGUTXIJUYJVVTHS-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.27
Rot. Bonds3

About (4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone

(4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone (PubChem CID 114640859) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is (4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone.

Molecular Properties

Compound Name(4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone
PubChem CID114640859
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name(4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone
SMILESCOc1cnn(C)c1C(=O)C1CC1C
InChIInChI=1S/C10H14N2O2/c1-6-4-7(6)10(13)9-8(14-3)5-11-12(9)2/h5-7H,4H2,1-3H3
InChIKeyGUTXIJUYJVVTHS-UHFFFAOYSA-N
XLogP1.27
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2-aminocyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanone
CID 114669670
(4-methoxy-1-methylpyrazol-5-yl)-(3-methylcyclohexyl)methanone
CID 114639658
6-bicyclo[3.1.0]hexanyl-(4-methoxy-1-methylpyrazol-5-yl)methanone
CID 115809767
7-bicyclo[4.1.0]heptanyl-(4-methoxy-1-methylpyrazol-5-yl)methanone
CID 115809603
4-methoxy-1-methylpyrazole-5-carboxylic acid
CID 46398720
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(4-methoxy-1-methylpyrazol-5-yl)methanone
CID 115809701
methyl 4-methoxy-1-methylpyrazole-5-carboxylate
CID 106942430
(4-methoxy-1-methylpyrazol-5-yl)-(thiolan-2-yl)methanone
CID 114641814
(4-methoxy-1-methylpyrazol-5-yl)-(1-piperidin-4-ylpyrrolidin-2-yl)methanone
CID 114668702
2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)-2-methylpropan-1-one
CID 114641358
1-(4-methoxy-1-methylpyrazol-5-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone
CID 105132702
1-(4-methoxy-1-methylpyrazol-5-yl)-2-piperidin-4-yloxyethanone
CID 114669257

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone?
The IUPAC name of (4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone (CID 114640859) is (4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone.
What is the SMILES notation for (4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone?
The canonical SMILES for (4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone is COc1cnn(C)c1C(=O)C1CC1C.
What is the InChIKey of (4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone?
The InChIKey is GUTXIJUYJVVTHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-6-4-7(6)10(13)9-8(14-3)5-11-12(9)2/h5-7H,4H2,1-3H3.
What are the key properties of (4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone?
(4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone has a molecular weight of 194.23 g/mol, XLogP of 1.27, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-1-methylpyrazol-5-yl)-(2-methylcyclopropyl)methanone is sourced from PubChem (CID 114640859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).