2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide

C24H37N3O — CID 25264793

About 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide

2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide (PubChem CID 25264793) has the molecular formula C24H37N3O and a molecular weight of 383.58 g/mol. Its IUPAC name is 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide.

Molecular Properties

• Compound Name: 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide
• PubChem CID: 25264793
• Molecular Formula: C24H37N3O
• Molecular Weight: 383.58 g/mol
• Exact Mass: 383.29
• IUPAC Name: 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide
• SMILES: Cc1cc(NC(=O)C2C(C)(C)C2(C)C)ccc1N1CCC(N2CCCC2C)C1
• InChI: InChI=1S/C24H37N3O/c1-16-14-18(25-22(28)21-23(3,4)24(21,5)6)9-10-20(16)26-13-11-19(15-26)27-12-7-8-17(27)2/h9-10,14,17,19,21H,7-8,11-13,15H2,1-6H3,(H,25,28)
• InChIKey: WXTBOKJYHOLEFC-UHFFFAOYSA-N
• XLogP: 4.68
• TPSA: 35.58 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 4
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	383.58
LogP ≤ 5	4.68
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide?

The IUPAC name of 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide (CID 25264793) is 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide.

What is the SMILES notation for 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide?

The canonical SMILES for 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide is Cc1cc(NC(=O)C2C(C)(C)C2(C)C)ccc1N1CCC(N2CCCC2C)C1.

What is the InChIKey of 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide?

The InChIKey is WXTBOKJYHOLEFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H37N3O/c1-16-14-18(25-22(28)21-23(3,4)24(21,5)6)9-10-20(16)26-13-11-19(15-26)27-12-7-8-17(27)2/h9-10,14,17,19,21H,7-8,11-13,15H2,1-6H3,(H,25,28).

What are the key properties of 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide?

2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide has a molecular weight of 383.58 g/mol, XLogP of 4.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2,2,3,3-tetramethyl-N-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 25264793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).