2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide

C19H21N5O2 — CID 109168019

IUPAC2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
SMILESN#Cc1ccccc1Nc1cc(C(=O)NCCN2CCOCC2)ccn1
InChIInChI=1S/C19H21N5O2/c20-14-16-3-1-2-4-17(16)23-18-13-15(5-6-21-18)19(25)22-7-8-24-9-11-26-12-10-24/h1-6,13H,7-12H2,(H,21,23)(H,22,25)
InChIKeyZOVJEHVSFYXUEJ-UHFFFAOYSA-N
MW351.41 g/mol
LogP1.76
Rot. Bonds6

About 2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide

2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide (PubChem CID 109168019) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
PubChem CID109168019
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
SMILESN#Cc1ccccc1Nc1cc(C(=O)NCCN2CCOCC2)ccn1
InChIInChI=1S/C19H21N5O2/c20-14-16-3-1-2-4-17(16)23-18-13-15(5-6-21-18)19(25)22-7-8-24-9-11-26-12-10-24/h1-6,13H,7-12H2,(H,21,23)(H,22,25)
InChIKeyZOVJEHVSFYXUEJ-UHFFFAOYSA-N
XLogP1.76
TPSA90.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-cyanophenyl)-2-(2-morpholin-4-ylethylamino)pyridine-4-carboxamide
CID 109168139
2-(2,3-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109167959
N-(2-morpholin-4-ylethyl)-2-(2,4,6-trimethylanilino)pyridine-4-carboxamide
CID 109167966
2-[[6-(2-morpholin-4-ylethylamino)pyrimidin-4-yl]amino]benzonitrile
CID 112857711
2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109167956
2-(2,4-dimethoxyanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109167991
N-[2-(4-chlorophenyl)ethyl]-2-(2-cyanoanilino)pyridine-4-carboxamide
CID 109173836
2-(2-cyanoanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 109172648
2-(1,3-benzodioxol-5-ylamino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109168006
N'-(2-cyanophenyl)-N-(2-morpholin-4-ylethyl)propanediamide
CID 108944134
2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109167907
N-(1,3-benzodioxol-5-ylmethyl)-2-(2-cyanoanilino)pyridine-4-carboxamide
CID 109171416

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The IUPAC name of 2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide (CID 109168019) is 2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide is N#Cc1ccccc1Nc1cc(C(=O)NCCN2CCOCC2)ccn1.
What is the InChIKey of 2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The InChIKey is ZOVJEHVSFYXUEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c20-14-16-3-1-2-4-17(16)23-18-13-15(5-6-21-18)19(25)22-7-8-24-9-11-26-12-10-24/h1-6,13H,7-12H2,(H,21,23)(H,22,25).
What are the key properties of 2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 1.76, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 109168019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).