4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide

C15H22N4O2 — CID 61215202

IUPAC4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)Nc2cccnc2N2CCCC2)C1
InChIInChI=1S/C15H22N4O2/c1-21-11-9-13(17-10-11)15(20)18-12-5-4-6-16-14(12)19-7-2-3-8-19/h4-6,11,13,17H,2-3,7-10H2,1H3,(H,18,20)
InChIKeyMNAGRIDDEAJCBX-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.00
Rot. Bonds4

About 4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide

4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide (PubChem CID 61215202) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide
PubChem CID61215202
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)Nc2cccnc2N2CCCC2)C1
InChIInChI=1S/C15H22N4O2/c1-21-11-9-13(17-10-11)15(20)18-12-5-4-6-16-14(12)19-7-2-3-8-19/h4-6,11,13,17H,2-3,7-10H2,1H3,(H,18,20)
InChIKeyMNAGRIDDEAJCBX-UHFFFAOYSA-N
XLogP1.00
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide?
The IUPAC name of 4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide (CID 61215202) is 4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide is COC1CNC(C(=O)Nc2cccnc2N2CCCC2)C1.
What is the InChIKey of 4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide?
The InChIKey is MNAGRIDDEAJCBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-21-11-9-13(17-10-11)15(20)18-12-5-4-6-16-14(12)19-7-2-3-8-19/h4-6,11,13,17H,2-3,7-10H2,1H3,(H,18,20).
What are the key properties of 4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide?
4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 61215202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).