2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine

C24H28N4 — CID 71238924

IUPAC2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
SMILESCc1ccccc1N1CCc2nc(-c3c(C)cccc3C)nc(N(C)C)c2C1
InChIInChI=1S/C24H28N4/c1-16-9-6-7-12-21(16)28-14-13-20-19(15-28)24(27(4)5)26-23(25-20)22-17(2)10-8-11-18(22)3/h6-12H,13-15H2,1-5H3
InChIKeyAMFBOVDUZWZNDH-UHFFFAOYSA-N
MW372.52 g/mol
LogP4.70
Rot. Bonds3

About 2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine

2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine (PubChem CID 71238924) has the molecular formula C24H28N4 and a molecular weight of 372.52 g/mol. Its IUPAC name is 2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
PubChem CID71238924
Molecular FormulaC24H28N4
Molecular Weight372.52 g/mol
Exact Mass372.23
IUPAC Name2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
SMILESCc1ccccc1N1CCc2nc(-c3c(C)cccc3C)nc(N(C)C)c2C1
InChIInChI=1S/C24H28N4/c1-16-9-6-7-12-21(16)28-14-13-20-19(15-28)24(27(4)5)26-23(25-20)22-17(2)10-8-11-18(22)3/h6-12H,13-15H2,1-5H3
InChIKeyAMFBOVDUZWZNDH-UHFFFAOYSA-N
XLogP4.70
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.52
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine (CID 71238924) is 2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine is Cc1ccccc1N1CCc2nc(-c3c(C)cccc3C)nc(N(C)C)c2C1.
What is the InChIKey of 2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine?
The InChIKey is AMFBOVDUZWZNDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4/c1-16-9-6-7-12-21(16)28-14-13-20-19(15-28)24(27(4)5)26-23(25-20)22-17(2)10-8-11-18(22)3/h6-12H,13-15H2,1-5H3.
What are the key properties of 2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine?
2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine has a molecular weight of 372.52 g/mol, XLogP of 4.70, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylphenyl)-N,N-dimethyl-6-(2-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine is sourced from PubChem (CID 71238924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).