1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine

C14H19N3O3 — CID 60809473

IUPAC1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine
SMILESCOc1ccc(CNc2ccn(C)n2)c(OC)c1OC
InChIInChI=1S/C14H19N3O3/c1-17-8-7-12(16-17)15-9-10-5-6-11(18-2)14(20-4)13(10)19-3/h5-8H,9H2,1-4H3,(H,15,16)
InChIKeyMZBGIGAXPLBEOC-UHFFFAOYSA-N
MW277.32 g/mol
LogP2.06
Rot. Bonds6

About 1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine

1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine (PubChem CID 60809473) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine.

Molecular Properties

Compound Name1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine
PubChem CID60809473
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine
SMILESCOc1ccc(CNc2ccn(C)n2)c(OC)c1OC
InChIInChI=1S/C14H19N3O3/c1-17-8-7-12(16-17)15-9-10-5-6-11(18-2)14(20-4)13(10)19-3/h5-8H,9H2,1-4H3,(H,15,16)
InChIKeyMZBGIGAXPLBEOC-UHFFFAOYSA-N
XLogP2.06
TPSA57.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[2-(difluoromethoxy)-3-methoxyphenyl]methyl]-1-methylpyrazol-3-amine
CID 60810315
N-[(3-ethoxy-2-methoxyphenyl)methyl]-1-methylpyrazol-3-amine
CID 54921625
4-chloro-2-methoxy-6-[[(1-methylpyrazol-3-yl)amino]methyl]phenol
CID 104646482
N-[(3,5-dibromo-4-methoxyphenyl)methyl]-1-methylpyrazol-3-amine
CID 60809796
5-bromo-N-[(2,3,4-trimethoxyphenyl)methyl]pyridin-2-amine
CID 75372885
N-[(2,3,4-trimethoxyphenyl)methyl]aniline
CID 3351558
N-[(2,3,4-trimethoxyphenyl)methyl]pyrrol-1-amine
CID 79090223
N-[(2-ethylphenyl)methyl]-1-methylpyrazol-3-amine
CID 62392134
N-[(4-methoxy-3-nitrophenyl)methyl]-1-methylpyrazol-3-amine
CID 79778259
N-[(2,3,4-trimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-amine
CID 103865640
1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine
CID 60808842
2-pyrazol-1-yl-N-[(2,3,4-trimethoxyphenyl)methyl]pyridin-3-amine
CID 75415259

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine?
The IUPAC name of 1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine (CID 60809473) is 1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine.
What is the SMILES notation for 1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine?
The canonical SMILES for 1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine is COc1ccc(CNc2ccn(C)n2)c(OC)c1OC.
What is the InChIKey of 1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine?
The InChIKey is MZBGIGAXPLBEOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-17-8-7-12(16-17)15-9-10-5-6-11(18-2)14(20-4)13(10)19-3/h5-8H,9H2,1-4H3,(H,15,16).
What are the key properties of 1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine?
1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine has a molecular weight of 277.32 g/mol, XLogP of 2.06, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine is sourced from PubChem (CID 60809473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).