(3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide

C19H26N6O2 — CID 129341824

About (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide

(3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide (PubChem CID 129341824) has the molecular formula C19H26N6O2 and a molecular weight of 370.46 g/mol. Its IUPAC name is (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide.

Molecular Properties

• Compound Name: (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide
• PubChem CID: 129341824
• Molecular Formula: C19H26N6O2
• Molecular Weight: 370.46 g/mol
• Exact Mass: 370.21
• IUPAC Name: (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide
• SMILES: Cn1nccc1CNC(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1
• InChI: InChI=1S/C19H26N6O2/c1-23-15(6-9-22-23)13-21-19(26)25-12-7-16(14-25)27-17-5-4-8-20-18(17)24-10-2-3-11-24/h4-6,8-9,16H,2-3,7,10-14H2,1H3,(H,21,26)/t16-/m1/s1
• InChIKey: ZJWWPSSCDBZRFW-MRXNPFEDSA-N
• XLogP: 1.78
• TPSA: 75.52 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	370.46
LogP ≤ 5	1.78
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide?

The IUPAC name of (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide (CID 129341824) is (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide.

What is the SMILES notation for (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide?

The canonical SMILES for (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide is Cn1nccc1CNC(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1.

What is the InChIKey of (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide?

The InChIKey is ZJWWPSSCDBZRFW-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H26N6O2/c1-23-15(6-9-22-23)13-21-19(26)25-12-7-16(14-25)27-17-5-4-8-20-18(17)24-10-2-3-11-24/h4-6,8-9,16H,2-3,7,10-14H2,1H3,(H,21,26)/t16-/m1/s1.

What are the key properties of (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide?

(3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide has a molecular weight of 370.46 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (3R)-N-[(2-methylpyrazol-3-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide is sourced from PubChem (CID 129341824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).