6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine

C22H29N3 — CID 22253394

IUPAC6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine
SMILESCCC(CC)n1ccc2c(Nc3c(C)cc(C)cc3C)nc(C)cc21
InChIInChI=1S/C22H29N3/c1-7-18(8-2)25-10-9-19-20(25)13-17(6)23-22(19)24-21-15(4)11-14(3)12-16(21)5/h9-13,18H,7-8H2,1-6H3,(H,23,24)
InChIKeyKUFMHJWXLJLJED-UHFFFAOYSA-N
MW335.50 g/mol
LogP6.37
Rot. Bonds5

About 6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine

6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine (PubChem CID 22253394) has the molecular formula C22H29N3 and a molecular weight of 335.50 g/mol. Its IUPAC name is 6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine.

Molecular Properties

Compound Name6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine
PubChem CID22253394
Molecular FormulaC22H29N3
Molecular Weight335.50 g/mol
Exact Mass335.24
IUPAC Name6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine
SMILESCCC(CC)n1ccc2c(Nc3c(C)cc(C)cc3C)nc(C)cc21
InChIInChI=1S/C22H29N3/c1-7-18(8-2)25-10-9-19-20(25)13-17(6)23-22(19)24-21-15(4)11-14(3)12-16(21)5/h9-13,18H,7-8H2,1-6H3,(H,23,24)
InChIKeyKUFMHJWXLJLJED-UHFFFAOYSA-N
XLogP6.37
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.50
LogP ≤ 56.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-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

3-methyl-5-pentan-3-yl-N-(2,4,6-trimethylphenyl)-2,6-naphthyridin-1-amine
CID 18386611
7-methyl-1-pentan-3-yl-5-(2,4,6-trimethylanilino)-2,4-dihydropyrido[3,4-b]pyrazin-3-one
CID 18386617
1-(1,3-dimethoxypropan-2-yl)-5-methyl-3-(2,4,6-trimethylanilino)pyrazin-2-one
CID 22004330
(2R)-1-[4-(4-fluoro-2,6-dimethylanilino)pyrrolo[3,2-c]pyridin-1-yl]butan-2-ol
CID 146288476
4-(2,6-dimethyl-4-propylphenoxy)-3,6-dimethyl-1-pentan-3-ylpyrrolo[3,2-c]pyridine
CID 22253378
(2R)-1-[4-(4-fluoro-2,6-dimethylanilino)pyrrolo[3,2-c]pyridin-1-yl]butan-2-ol;(2S)-1-[4-(4-fluoro-2,6-dimethylanilino)pyrrolo[3,2-c]pyridin-1-yl]butan-2-ol;methane
CID 158234871
3-hexan-3-yl-5-methyl-N-(2,4,6-trimethylphenyl)triazolo[4,5-d]pyrimidin-7-amine
CID 12051964
6-methyl-2-pentan-3-yloxy-4-N-(2,4,6-trimethylphenyl)pyridine-3,4-diamine
CID 22291304
5-methyl-7-N-(2,4,6-trimethylphenyl)-[1,2]thiazolo[5,4-c]pyridine-3,7-diamine
CID 139729469
3-heptan-3-yl-5-methyl-N-(2,4,6-trimethylphenyl)triazolo[4,5-d]pyrimidin-7-amine
CID 12051965
10-(2,4-dimethyl-6-propan-2-ylphenyl)-7,11-dimethyl-3-pentan-3-yl-1,3,8,12-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene
CID 22249838
1-(2,2-difluoropropyl)-N-(2,4,6-trimethyl-3-pyridinyl)pyrrolo[3,2-c]pyridin-4-amine
CID 162002734

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine?
The IUPAC name of 6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine (CID 22253394) is 6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine.
What is the SMILES notation for 6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine?
The canonical SMILES for 6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine is CCC(CC)n1ccc2c(Nc3c(C)cc(C)cc3C)nc(C)cc21.
What is the InChIKey of 6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine?
The InChIKey is KUFMHJWXLJLJED-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3/c1-7-18(8-2)25-10-9-19-20(25)13-17(6)23-22(19)24-21-15(4)11-14(3)12-16(21)5/h9-13,18H,7-8H2,1-6H3,(H,23,24).
What are the key properties of 6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine?
6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine has a molecular weight of 335.50 g/mol, XLogP of 6.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-pentan-3-yl-N-(2,4,6-trimethylphenyl)pyrrolo[3,2-c]pyridin-4-amine is sourced from PubChem (CID 22253394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).