N-methyl-1-(3-methylphenyl)pyrazol-3-amine

C11H13N3 — CID 83876804

IUPACN-methyl-1-(3-methylphenyl)pyrazol-3-amine
SMILESCNc1ccn(-c2cccc(C)c2)n1
InChIInChI=1S/C11H13N3/c1-9-4-3-5-10(8-9)14-7-6-11(12-2)13-14/h3-8H,1-2H3,(H,12,13)
InChIKeyAMTLJUKOVGYDJG-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.22
Rot. Bonds2

About N-methyl-1-(3-methylphenyl)pyrazol-3-amine

N-methyl-1-(3-methylphenyl)pyrazol-3-amine (PubChem CID 83876804) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is N-methyl-1-(3-methylphenyl)pyrazol-3-amine.

Molecular Properties

Compound NameN-methyl-1-(3-methylphenyl)pyrazol-3-amine
PubChem CID83876804
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC NameN-methyl-1-(3-methylphenyl)pyrazol-3-amine
SMILESCNc1ccn(-c2cccc(C)c2)n1
InChIInChI=1S/C11H13N3/c1-9-4-3-5-10(8-9)14-7-6-11(12-2)13-14/h3-8H,1-2H3,(H,12,13)
InChIKeyAMTLJUKOVGYDJG-UHFFFAOYSA-N
XLogP2.22
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide
CID 16678852
3-(3-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide
CID 55547813
N-[(2,5-dimethylphenyl)methyl]-1-phenylpyrazol-3-amine
CID 55923444
1-phenyl-N-(2,3,5,6-tetramethylphenyl)pyrazol-3-amine
CID 173348604
1-(3-chloro-2-pyridinyl)-N-methylpyrazol-3-amine
CID 130684274
4-(1-bromoethyl)-1-(3-methylphenyl)triazole
CID 81445146
5-methyl-2-(3-methylphenyl)benzotriazole
CID 57226885
N-methyl-3-[1-(3-methylphenyl)pyrazol-4-yl]oxypropan-1-amine
CID 117230384
N-methyl-4-[4-(3-methylphenyl)piperazin-1-yl]aniline
CID 112722053
3-[2-(3-methylphenyl)pyrazol-3-yl]-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one
CID 66710696
1-methyl-2-(3-methylphenyl)pyridazine-3,6-dione
CID 13027273
N-methyl-1-[3-(3-methylphenyl)imidazol-4-yl]methanamine
CID 83881035

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methylphenyl)pyrazol-3-amine?
The IUPAC name of N-methyl-1-(3-methylphenyl)pyrazol-3-amine (CID 83876804) is N-methyl-1-(3-methylphenyl)pyrazol-3-amine.
What is the SMILES notation for N-methyl-1-(3-methylphenyl)pyrazol-3-amine?
The canonical SMILES for N-methyl-1-(3-methylphenyl)pyrazol-3-amine is CNc1ccn(-c2cccc(C)c2)n1.
What is the InChIKey of N-methyl-1-(3-methylphenyl)pyrazol-3-amine?
The InChIKey is AMTLJUKOVGYDJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-9-4-3-5-10(8-9)14-7-6-11(12-2)13-14/h3-8H,1-2H3,(H,12,13).
What are the key properties of N-methyl-1-(3-methylphenyl)pyrazol-3-amine?
N-methyl-1-(3-methylphenyl)pyrazol-3-amine has a molecular weight of 187.25 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methylphenyl)pyrazol-3-amine is sourced from PubChem (CID 83876804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).