N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide

C15H16N4O — CID 84574823

IUPACN-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide
SMILESO=C(Nc1ccccn1)c1ccnc(N2CCCC2)c1
InChIInChI=1S/C15H16N4O/c20-15(18-13-5-1-2-7-16-13)12-6-8-17-14(11-12)19-9-3-4-10-19/h1-2,5-8,11H,3-4,9-10H2,(H,16,18,20)
InChIKeyINCFOWYZFPZVTB-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.33
Rot. Bonds3

About N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide

N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide (PubChem CID 84574823) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide
PubChem CID84574823
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC NameN-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide
SMILESO=C(Nc1ccccn1)c1ccnc(N2CCCC2)c1
InChIInChI=1S/C15H16N4O/c20-15(18-13-5-1-2-7-16-13)12-6-8-17-14(11-12)19-9-3-4-10-19/h1-2,5-8,11H,3-4,9-10H2,(H,16,18,20)
InChIKeyINCFOWYZFPZVTB-UHFFFAOYSA-N
XLogP2.33
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide?
The IUPAC name of N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide (CID 84574823) is N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide.
What is the SMILES notation for N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide?
The canonical SMILES for N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide is O=C(Nc1ccccn1)c1ccnc(N2CCCC2)c1.
What is the InChIKey of N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide?
The InChIKey is INCFOWYZFPZVTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c20-15(18-13-5-1-2-7-16-13)12-6-8-17-14(11-12)19-9-3-4-10-19/h1-2,5-8,11H,3-4,9-10H2,(H,16,18,20).
What are the key properties of N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide?
N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide has a molecular weight of 268.32 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-2-yl-2-pyrrolidin-1-ylpyridine-4-carboxamide is sourced from PubChem (CID 84574823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).