N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide

C30H35N5O — CID 42480572

About N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide

N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide (PubChem CID 42480572) has the molecular formula C30H35N5O and a molecular weight of 481.64 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide.

Molecular Properties

• Compound Name: N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide
• PubChem CID: 42480572
• Molecular Formula: C30H35N5O
• Molecular Weight: 481.64 g/mol
• Exact Mass: 481.28
• IUPAC Name: N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide
• SMILES: Cc1cccc(-c2nc3cc4c(cc3cc2CN(CCN(C)C)C(=O)c2cc(C)nn2C)CCC4)c1
• InChI: InChI=1S/C30H35N5O/c1-20-8-6-11-24(14-20)29-26(17-25-16-22-9-7-10-23(22)18-27(25)31-29)19-35(13-12-33(3)4)30(36)28-15-21(2)32-34(28)5/h6,8,11,14-18H,7,9-10,12-13,19H2,1-5H3
• InChIKey: IZACZKJSUUSYEQ-UHFFFAOYSA-N
• XLogP: 4.94
• TPSA: 54.26 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	481.64
LogP ≤ 5	4.94
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide?

The IUPAC name of N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide (CID 42480572) is N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide.

What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide?

The canonical SMILES for N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide is Cc1cccc(-c2nc3cc4c(cc3cc2CN(CCN(C)C)C(=O)c2cc(C)nn2C)CCC4)c1.

What is the InChIKey of N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide?

The InChIKey is IZACZKJSUUSYEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H35N5O/c1-20-8-6-11-24(14-20)29-26(17-25-16-22-9-7-10-23(22)18-27(25)31-29)19-35(13-12-33(3)4)30(36)28-15-21(2)32-34(28)5/h6,8,11,14-18H,7,9-10,12-13,19H2,1-5H3.

What are the key properties of N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide?

N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide has a molecular weight of 481.64 g/mol, XLogP of 4.94, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(dimethylamino)ethyl]-2,5-dimethyl-N-[[2-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl]pyrazole-3-carboxamide is sourced from PubChem (CID 42480572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).