N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide

C20H20N4O — CID 10149873

IUPACN-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide
SMILESCc1cc(N2CCCC2)c2ccc(NC(=O)c3cccnc3)cc2n1
InChIInChI=1S/C20H20N4O/c1-14-11-19(24-9-2-3-10-24)17-7-6-16(12-18(17)22-14)23-20(25)15-5-4-8-21-13-15/h4-8,11-13H,2-3,9-10H2,1H3,(H,23,25)
InChIKeyUPTVWHNDQOIPGI-UHFFFAOYSA-N
MW332.41 g/mol
LogP3.79
Rot. Bonds3

About N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide

N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide (PubChem CID 10149873) has the molecular formula C20H20N4O and a molecular weight of 332.41 g/mol. Its IUPAC name is N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide
PubChem CID10149873
Molecular FormulaC20H20N4O
Molecular Weight332.41 g/mol
Exact Mass332.16
IUPAC NameN-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide
SMILESCc1cc(N2CCCC2)c2ccc(NC(=O)c3cccnc3)cc2n1
InChIInChI=1S/C20H20N4O/c1-14-11-19(24-9-2-3-10-24)17-7-6-16(12-18(17)22-14)23-20(25)15-5-4-8-21-13-15/h4-8,11-13H,2-3,9-10H2,1H3,(H,23,25)
InChIKeyUPTVWHNDQOIPGI-UHFFFAOYSA-N
XLogP3.79
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide?
The IUPAC name of N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide (CID 10149873) is N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide is Cc1cc(N2CCCC2)c2ccc(NC(=O)c3cccnc3)cc2n1.
What is the InChIKey of N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide?
The InChIKey is UPTVWHNDQOIPGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O/c1-14-11-19(24-9-2-3-10-24)17-7-6-16(12-18(17)22-14)23-20(25)15-5-4-8-21-13-15/h4-8,11-13H,2-3,9-10H2,1H3,(H,23,25).
What are the key properties of N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide?
N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide has a molecular weight of 332.41 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)pyridine-3-carboxamide is sourced from PubChem (CID 10149873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).