N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine

C17H23N3 — CID 60924897

IUPACN-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
SMILESCCc1cccc(C)c1NC1CCCc2c1cnn2C
InChIInChI=1S/C17H23N3/c1-4-13-8-5-7-12(2)17(13)19-15-9-6-10-16-14(15)11-18-20(16)3/h5,7-8,11,15,19H,4,6,9-10H2,1-3H3
InChIKeyFKXKJPXUIGUOEJ-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.78
Rot. Bonds3

About N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine

N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (PubChem CID 60924897) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
PubChem CID60924897
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC NameN-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
SMILESCCc1cccc(C)c1NC1CCCc2c1cnn2C
InChIInChI=1S/C17H23N3/c1-4-13-8-5-7-12(2)17(13)19-15-9-6-10-16-14(15)11-18-20(16)3/h5,7-8,11,15,19H,4,6,9-10H2,1-3H3
InChIKeyFKXKJPXUIGUOEJ-UHFFFAOYSA-N
XLogP3.78
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethyl-6-methylphenyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 63448457
2-bromo-6-[[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]methyl]phenol
CID 61391448
1-methyl-N-(4-methyl-3-pyridinyl)-4,5,6,7-tetrahydroindazol-4-amine
CID 63329281
2-chloro-N-(2-ethyl-6-methylphenyl)-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 82689949
3-methoxy-2-[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]benzonitrile
CID 107466622
N-(6-fluoro-2-pyridinyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
CID 113234559
N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]ethanesulfonamide
CID 94197139
N-(2-chlorophenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
CID 43254584
N-(2-iodophenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
CID 43254701
1-methyl-N-propyl-4,5,6,7-tetrahydroindazol-4-amine
CID 43254492
4-ethyl-5-methyl-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)thiophene-2-carboxamide
CID 42956258
2-methoxy-6-[[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]methyl]phenol
CID 43727366

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (CID 60924897) is N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine is CCc1cccc(C)c1NC1CCCc2c1cnn2C.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine?
The InChIKey is FKXKJPXUIGUOEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-4-13-8-5-7-12(2)17(13)19-15-9-6-10-16-14(15)11-18-20(16)3/h5,7-8,11,15,19H,4,6,9-10H2,1-3H3.
What are the key properties of N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine?
N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine has a molecular weight of 269.39 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine is sourced from PubChem (CID 60924897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).