[1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine

C15H19N3 — CID 116818504

IUPAC[1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine
SMILESCc1ccccc1-n1nc(C2(CN)CC2)cc1C
InChIInChI=1S/C15H19N3/c1-11-5-3-4-6-13(11)18-12(2)9-14(17-18)15(10-16)7-8-15/h3-6,9H,7-8,10,16H2,1-2H3
InChIKeyDQEDVBJBTBBBCA-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.48
Rot. Bonds3

About [1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine

[1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine (PubChem CID 116818504) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is [1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine
PubChem CID116818504
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name[1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine
SMILESCc1ccccc1-n1nc(C2(CN)CC2)cc1C
InChIInChI=1S/C15H19N3/c1-11-5-3-4-6-13(11)18-12(2)9-14(17-18)15(10-16)7-8-15/h3-6,9H,7-8,10,16H2,1-2H3
InChIKeyDQEDVBJBTBBBCA-UHFFFAOYSA-N
XLogP2.48
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine
CID 116818468
[1-[1-(3-bromophenyl)-5-methylpyrazol-3-yl]cyclopropyl]methanamine
CID 116818525
3-bromo-5-methyl-1-(2-methylphenyl)pyrazole
CID 59022551
N,N,5-trimethyl-1-(2-methylphenyl)pyrazol-3-amine
CID 116817637
3-(hydroxymethyl)-6-methyl-1-(2-methylphenyl)pyridazin-4-one
CID 82419602
4-(aminomethyl)-1-(2-methylphenyl)piperidin-4-ol
CID 82286374
[4-(aminomethyl)-1-(2-methylphenyl)piperidin-4-yl]methanamine
CID 117007839
3-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]propanoic acid
CID 82159419
(3-amino-3-phenylpyrrolidin-1-yl)-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]methanone
CID 166362262
[1-(2-methylphenyl)-4,6-dihydrofuro[3,4-d]pyrazol-3-yl]methanamine
CID 83862188
[1-(2-bromophenyl)-5-methylpyrazol-3-yl]methanamine
CID 82091921
4-(aminomethyl)-1-(2-methylphenyl)pyrazole-3,5-diamine
CID 115056348

Frequently Asked Questions

What is the IUPAC name of [1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine?
The IUPAC name of [1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine (CID 116818504) is [1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine.
What is the SMILES notation for [1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine?
The canonical SMILES for [1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine is Cc1ccccc1-n1nc(C2(CN)CC2)cc1C.
What is the InChIKey of [1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine?
The InChIKey is DQEDVBJBTBBBCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-5-3-4-6-13(11)18-12(2)9-14(17-18)15(10-16)7-8-15/h3-6,9H,7-8,10,16H2,1-2H3.
What are the key properties of [1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine?
[1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine has a molecular weight of 241.34 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[5-methyl-1-(2-methylphenyl)pyrazol-3-yl]cyclopropyl]methanamine is sourced from PubChem (CID 116818504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).