4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine

C15H19N3O2 — CID 117435948

IUPAC4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine
SMILESCOc1cc(-c2cnn(C)c2N)ccc1OCC1CC1
InChIInChI=1S/C15H19N3O2/c1-18-15(16)12(8-17-18)11-5-6-13(14(7-11)19-2)20-9-10-3-4-10/h5-8,10H,3-4,9,16H2,1-2H3
InChIKeyLGBBIRSJSCHCQV-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.47
Rot. Bonds5

About 4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine

4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine (PubChem CID 117435948) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine
PubChem CID117435948
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine
SMILESCOc1cc(-c2cnn(C)c2N)ccc1OCC1CC1
InChIInChI=1S/C15H19N3O2/c1-18-15(16)12(8-17-18)11-5-6-13(14(7-11)19-2)20-9-10-3-4-10/h5-8,10H,3-4,9,16H2,1-2H3
InChIKeyLGBBIRSJSCHCQV-UHFFFAOYSA-N
XLogP2.47
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[4-chloro-3-(cyclopropylmethoxy)phenyl]-1-methylpyrazol-5-amine
CID 117445254
4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1H-pyrazol-5-amine
CID 117401936
4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1,2-oxazol-5-amine
CID 117404879
4-(3-cyclohexyl-4-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117459944
4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine
CID 117370777
4-[3,5-dimethoxy-4-(methoxymethyl)phenyl]-1-methylpyrazol-5-amine
CID 117444289
4-(3,4-dimethylphenyl)-1-methylpyrazol-5-amine
CID 62901487
4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117431595
5-(5-amino-1-methylpyrazol-4-yl)-2,3-dimethoxybenzonitrile
CID 117399239
4-(3-bromo-4-cyclopropylphenyl)-1-methylpyrazol-5-amine
CID 117471763
4-(3,4-dimethoxyphenyl)-1-phenylpyrazol-5-amine
CID 767167
4-(3-fluoro-4-phenylmethoxyphenyl)-1-methylpyrazol-5-amine
CID 117478888

Frequently Asked Questions

What is the IUPAC name of 4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine?
The IUPAC name of 4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine (CID 117435948) is 4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine?
The canonical SMILES for 4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine is COc1cc(-c2cnn(C)c2N)ccc1OCC1CC1.
What is the InChIKey of 4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine?
The InChIKey is LGBBIRSJSCHCQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-18-15(16)12(8-17-18)11-5-6-13(14(7-11)19-2)20-9-10-3-4-10/h5-8,10H,3-4,9,16H2,1-2H3.
What are the key properties of 4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine?
4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine has a molecular weight of 273.34 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine is sourced from PubChem (CID 117435948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).