3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine

C15H23N3 — CID 103126789

IUPAC3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine
SMILESCCCC(C)CC(N)c1nn(C)c2ccccc12
InChIInChI=1S/C15H23N3/c1-4-7-11(2)10-13(16)15-12-8-5-6-9-14(12)18(3)17-15/h5-6,8-9,11,13H,4,7,10,16H2,1-3H3
InChIKeyZDBILEWWEUVZGL-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.40
Rot. Bonds5

About 3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine

3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine (PubChem CID 103126789) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine.

Molecular Properties

Compound Name3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine
PubChem CID103126789
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine
SMILESCCCC(C)CC(N)c1nn(C)c2ccccc12
InChIInChI=1S/C15H23N3/c1-4-7-11(2)10-13(16)15-12-8-5-6-9-14(12)18(3)17-15/h5-6,8-9,11,13H,4,7,10,16H2,1-3H3
InChIKeyZDBILEWWEUVZGL-UHFFFAOYSA-N
XLogP3.40
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-(1-methylindazol-3-yl)ethanol
CID 82604101
(1S)-1-(1-methylindazol-3-yl)ethanamine
CID 96741257
3-methyl-1-(1-methylindazol-3-yl)pentan-1-ol
CID 103128712
N-ethyl-1-(1-methylindazol-3-yl)butan-1-amine
CID 103125829
2-(2,6-dichlorophenyl)-1-(1-methylindazol-3-yl)ethanamine
CID 103126528
1-(1-methylindazol-3-yl)-2-(1-methylpyrazol-3-yl)ethanamine
CID 103127966
1-(1-methylindazol-3-yl)oct-7-en-1-amine
CID 107012125
1-(1-methylindazol-3-yl)heptan-1-ol
CID 103128650
1-(1-methylindazol-3-yl)-2-(2-propan-2-yl-1,2,4-triazol-3-yl)ethanamine
CID 103127544
1-(1-methylindazol-3-yl)propylhydrazine
CID 103129371
2-(2-methoxyphenyl)-1-(1-methylindazol-3-yl)ethanamine
CID 103126355
3-(difluoromethyl)-1-methylindazole
CID 153487584

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine?
The IUPAC name of 3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine (CID 103126789) is 3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine.
What is the SMILES notation for 3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine?
The canonical SMILES for 3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine is CCCC(C)CC(N)c1nn(C)c2ccccc12.
What is the InChIKey of 3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine?
The InChIKey is ZDBILEWWEUVZGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-4-7-11(2)10-13(16)15-12-8-5-6-9-14(12)18(3)17-15/h5-6,8-9,11,13H,4,7,10,16H2,1-3H3.
What are the key properties of 3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine?
3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine has a molecular weight of 245.37 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine is sourced from PubChem (CID 103126789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).