(1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone

C16H20N2O3 — CID 115810337

IUPAC(1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone
SMILESCCCOc1cccc(C(=O)c2c(OC)cnn2CC)c1
InChIInChI=1S/C16H20N2O3/c1-4-9-21-13-8-6-7-12(10-13)16(19)15-14(20-3)11-17-18(15)5-2/h6-8,10-11H,4-5,9H2,1-3H3
InChIKeyRFMHKOLCRYIPDO-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.93
Rot. Bonds7

About (1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone

(1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone (PubChem CID 115810337) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is (1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone.

Molecular Properties

Compound Name(1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone
PubChem CID115810337
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name(1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone
SMILESCCCOc1cccc(C(=O)c2c(OC)cnn2CC)c1
InChIInChI=1S/C16H20N2O3/c1-4-9-21-13-8-6-7-12(10-13)16(19)15-14(20-3)11-17-18(15)5-2/h6-8,10-11H,4-5,9H2,1-3H3
InChIKeyRFMHKOLCRYIPDO-UHFFFAOYSA-N
XLogP2.93
TPSA53.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone 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

(4-methoxy-1-methylpyrazol-5-yl)-(3-propoxyphenyl)methanone
CID 115809753
(1-ethyl-4-methoxypyrazol-5-yl)-(3-methylsulfonylphenyl)methanone
CID 115810193
1-(1-ethyl-4-methoxypyrazol-5-yl)-3-phenoxypropan-1-one
CID 114638771
(5-bromothiophen-3-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanone
CID 105133000
[4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone
CID 105132998
(5-iodo-2-methoxyphenyl)-(3-propoxyphenyl)methanone
CID 63490601
(1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanamine
CID 105047835
(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methanone
CID 106847992
(3-propoxyphenyl)-(3-propylphenyl)methanone
CID 115812256
[4-bromo-1-(2-methoxyethyl)pyrazol-5-yl]-(3-ethoxyphenyl)methanone
CID 114638798
acetyl 3-propoxybenzoate
CID 54339605
(5-chloro-2-methoxyphenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methanone
CID 115810197

Frequently Asked Questions

What is the IUPAC name of (1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone?
The IUPAC name of (1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone (CID 115810337) is (1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone.
What is the SMILES notation for (1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone?
The canonical SMILES for (1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone is CCCOc1cccc(C(=O)c2c(OC)cnn2CC)c1.
What is the InChIKey of (1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone?
The InChIKey is RFMHKOLCRYIPDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-4-9-21-13-8-6-7-12(10-13)16(19)15-14(20-3)11-17-18(15)5-2/h6-8,10-11H,4-5,9H2,1-3H3.
What are the key properties of (1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone?
(1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone has a molecular weight of 288.35 g/mol, XLogP of 2.93, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone is sourced from PubChem (CID 115810337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).