4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine

C15H21N3O2 — CID 117440661

IUPAC4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine
SMILESCOc1ccc(C(C)C)c(-c2cnn(C)c2N)c1OC
InChIInChI=1S/C15H21N3O2/c1-9(2)10-6-7-12(19-4)14(20-5)13(10)11-8-17-18(3)15(11)16/h6-9H,16H2,1-5H3
InChIKeyWLAZOHOOTOFKKO-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.81
Rot. Bonds4

About 4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine

4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine (PubChem CID 117440661) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine
PubChem CID117440661
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine
SMILESCOc1ccc(C(C)C)c(-c2cnn(C)c2N)c1OC
InChIInChI=1S/C15H21N3O2/c1-9(2)10-6-7-12(19-4)14(20-5)13(10)11-8-17-18(3)15(11)16/h6-9H,16H2,1-5H3
InChIKeyWLAZOHOOTOFKKO-UHFFFAOYSA-N
XLogP2.81
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-methoxy-3-methyl-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine
CID 117402644
2-(5-amino-1-methylpyrazol-4-yl)-3,6-di(propan-2-yl)phenol
CID 117436539
4-(2,3-dimethoxy-5,6-dimethylphenyl)-1-methylpyrazol-5-amine
CID 117407767
4-(3-bromo-6-methoxy-2-methylphenyl)-1-methylpyrazol-5-amine
CID 117477177
4-(3-fluoro-2-methoxy-6-methylphenyl)-1-methylpyrazol-5-amine
CID 117342062
4-[5-(1-fluoroethyl)-2,3-dimethoxyphenyl]-1-methylpyrazol-5-amine
CID 117447770
4-(2,4-difluoro-3,5-dimethoxyphenyl)-1-methylpyrazol-5-amine
CID 117426009
4-(4,6-difluoro-2,3-dimethoxyphenyl)-1-methylpyrazol-5-amine
CID 117426013
(5-amino-1-methylpyrazol-4-yl)-(3-bromo-2,4-dimethoxyphenyl)methanol
CID 103523206
4-(3-chloro-2,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine
CID 117452245
1-methyl-4-(2-propan-2-ylphenyl)pyrazol-5-amine
CID 117307113
4-[2,5-di(propan-2-yl)phenyl]-1-methylpyrazol-5-amine
CID 117397196

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine?
The IUPAC name of 4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine (CID 117440661) is 4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine?
The canonical SMILES for 4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine is COc1ccc(C(C)C)c(-c2cnn(C)c2N)c1OC.
What is the InChIKey of 4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine?
The InChIKey is WLAZOHOOTOFKKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-9(2)10-6-7-12(19-4)14(20-5)13(10)11-8-17-18(3)15(11)16/h6-9H,16H2,1-5H3.
What are the key properties of 4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine?
4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine has a molecular weight of 275.35 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethoxy-6-propan-2-ylphenyl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 117440661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).