N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine

C19H22N4O — CID 166364458

IUPACN-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine
SMILESCOc1cc(C)ncc1CNc1cc(C)n(-c2ccc(C)cc2)n1
InChIInChI=1S/C19H22N4O/c1-13-5-7-17(8-6-13)23-15(3)10-19(22-23)21-12-16-11-20-14(2)9-18(16)24-4/h5-11H,12H2,1-4H3,(H,21,22)
InChIKeyZVXYMMPPZNVBSQ-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.81
Rot. Bonds5

About N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine

N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine (PubChem CID 166364458) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine.

Molecular Properties

Compound NameN-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine
PubChem CID166364458
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC NameN-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine
SMILESCOc1cc(C)ncc1CNc1cc(C)n(-c2ccc(C)cc2)n1
InChIInChI=1S/C19H22N4O/c1-13-5-7-17(8-6-13)23-15(3)10-19(22-23)21-12-16-11-20-14(2)9-18(16)24-4/h5-11H,12H2,1-4H3,(H,21,22)
InChIKeyZVXYMMPPZNVBSQ-UHFFFAOYSA-N
XLogP3.81
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(5-bromo-1H-imidazol-2-yl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine
CID 139016321
1-(4-methoxy-6-methyl-3-pyridinyl)-N-methylmethanamine
CID 81254703
4-chloro-N-[[2-methoxy-4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-1,3,5-triazin-2-amine
CID 177165312
2-(7-methoxy-4,8-dimethyl-2-oxochromen-3-yl)-N-[5-methyl-1-(4-methylphenyl)pyrazol-3-yl]acetamide
CID 4899443
2-[[5-methyl-1-(4-methylphenyl)pyrazol-3-yl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 75497567
N-[(3,4-dimethoxyphenyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazole-3-carboxamide
CID 110372802
5-(3-tert-butyl-5-methylpyrazol-1-yl)-2-methoxypyridine
CID 59588874
N-[(5-bromo-2-methoxyphenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
CID 133284649
6-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylphenyl)methyl]pyrimidin-4-amine
CID 50830713
5-(3,5-dimethylpyrazol-1-yl)-2-methoxybenzoic acid
CID 82513661
N-[(2-methoxy-4-methylphenyl)methyl]-3-nitroimidazo[1,2-b]pyridazin-6-amine
CID 133419819
N-[(2,4-dimethylphenyl)methyl]-3-(3-methoxy-4-methylphenyl)imidazo[1,2-b]pyridazin-6-amine
CID 140905268

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine?
The IUPAC name of N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine (CID 166364458) is N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine.
What is the SMILES notation for N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine?
The canonical SMILES for N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine is COc1cc(C)ncc1CNc1cc(C)n(-c2ccc(C)cc2)n1.
What is the InChIKey of N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine?
The InChIKey is ZVXYMMPPZNVBSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O/c1-13-5-7-17(8-6-13)23-15(3)10-19(22-23)21-12-16-11-20-14(2)9-18(16)24-4/h5-11H,12H2,1-4H3,(H,21,22).
What are the key properties of N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine?
N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine has a molecular weight of 322.41 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxy-6-methyl-3-pyridinyl)methyl]-5-methyl-1-(4-methylphenyl)pyrazol-3-amine is sourced from PubChem (CID 166364458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).