N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide

C23H39N5O3 — CID 146753483

About N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide

N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 146753483) has the molecular formula C23H39N5O3 and a molecular weight of 433.60 g/mol. Its IUPAC name is N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide
• PubChem CID: 146753483
• Molecular Formula: C23H39N5O3
• Molecular Weight: 433.60 g/mol
• Exact Mass: 433.31
• IUPAC Name: N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide
• SMILES: COCC1(N(C)C(=O)C2NNC3CCN(C(=O)C4CC5C(C)CCCC5N4)CC32)CC1
• InChI: InChI=1S/C23H39N5O3/c1-14-5-4-6-17-15(14)11-19(24-17)21(29)28-10-7-18-16(12-28)20(26-25-18)22(30)27(2)23(8-9-23)13-31-3/h14-20,24-26H,4-13H2,1-3H3
• InChIKey: XLAIRJSCDCVLCA-UHFFFAOYSA-N
• XLogP: 0.48
• TPSA: 85.94 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	433.60
LogP ≤ 5	0.48
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide?

The IUPAC name of N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide (CID 146753483) is N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide.

What is the SMILES notation for N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide?

The canonical SMILES for N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide is COCC1(N(C)C(=O)C2NNC3CCN(C(=O)C4CC5C(C)CCCC5N4)CC32)CC1.

What is the InChIKey of N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide?

The InChIKey is XLAIRJSCDCVLCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H39N5O3/c1-14-5-4-6-17-15(14)11-19(24-17)21(29)28-10-7-18-16(12-28)20(26-25-18)22(30)27(2)23(8-9-23)13-31-3/h14-20,24-26H,4-13H2,1-3H3.

What are the key properties of N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide?

N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 433.60 g/mol, XLogP of 0.48, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-(methoxymethyl)cyclopropyl]-N-methyl-5-(4-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 146753483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).