N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine

C15H19N3O — CID 116827533

IUPACN-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine
SMILESCOc1ccc(C)cc1-c1cc(NC2CC2)nn1C
InChIInChI=1S/C15H19N3O/c1-10-4-7-14(19-3)12(8-10)13-9-15(17-18(13)2)16-11-5-6-11/h4,7-9,11H,5-6H2,1-3H3,(H,16,17)
InChIKeyTWEKOTGJMQUYOE-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.98
Rot. Bonds4

About N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine

N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine (PubChem CID 116827533) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine.

Molecular Properties

Compound NameN-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine
PubChem CID116827533
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine
SMILESCOc1ccc(C)cc1-c1cc(NC2CC2)nn1C
InChIInChI=1S/C15H19N3O/c1-10-4-7-14(19-3)12(8-10)13-9-15(17-18(13)2)16-11-5-6-11/h4,7-9,11H,5-6H2,1-3H3,(H,16,17)
InChIKeyTWEKOTGJMQUYOE-UHFFFAOYSA-N
XLogP2.98
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-yl]methanethiol
CID 82159589
4-[5-(2-methoxy-5-methylphenyl)-1-methylpyrazole-3-carbonyl]piperazine-1-carbaldehyde
CID 110336762
2-[5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-yl]acetic acid
CID 82484421
5-(2-methoxy-5-methylphenyl)-1-methyl-N-propylpyrazole-3-carboxamide
CID 110336742
[5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 110336780
N-(2,4-dimethoxyphenyl)-5-(2-methoxy-5-methylphenyl)-1-methylpyrazole-3-carboxamide
CID 110336792
5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine
CID 116827490
5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-methylpropyl)pyrazole-3-carboxamide
CID 110336747
5-(2-methoxy-5-methylphenyl)-1-methyl-N-prop-2-enylpyrazole-3-carboxamide
CID 110336745
5-(4-butan-2-ylphenyl)-N-cyclopropyl-1-methylpyrazol-3-amine
CID 116827540
5-(2,4-dimethoxy-3-methylphenyl)-N,1-dimethylpyrazol-3-amine
CID 116827447
5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
CID 110336758

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine?
The IUPAC name of N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine (CID 116827533) is N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine.
What is the SMILES notation for N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine?
The canonical SMILES for N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine is COc1ccc(C)cc1-c1cc(NC2CC2)nn1C.
What is the InChIKey of N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine?
The InChIKey is TWEKOTGJMQUYOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10-4-7-14(19-3)12(8-10)13-9-15(17-18(13)2)16-11-5-6-11/h4,7-9,11H,5-6H2,1-3H3,(H,16,17).
What are the key properties of N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine?
N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine has a molecular weight of 257.34 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine is sourced from PubChem (CID 116827533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).