N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide

C22H23N5O2 — CID 109171960

IUPACN-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
SMILESO=C(Nc1ccccc1N1CCOCC1)c1ccnc(NCc2cccnc2)c1
InChIInChI=1S/C22H23N5O2/c28-22(26-19-5-1-2-6-20(19)27-10-12-29-13-11-27)18-7-9-24-21(14-18)25-16-17-4-3-8-23-15-17/h1-9,14-15H,10-13,16H2,(H,24,25)(H,26,28)
InChIKeyKKNCQQGFVUSCSE-UHFFFAOYSA-N
MW389.46 g/mol
LogP3.18
Rot. Bonds6

About N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide

N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide (PubChem CID 109171960) has the molecular formula C22H23N5O2 and a molecular weight of 389.46 g/mol. Its IUPAC name is N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
PubChem CID109171960
Molecular FormulaC22H23N5O2
Molecular Weight389.46 g/mol
Exact Mass389.19
IUPAC NameN-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
SMILESO=C(Nc1ccccc1N1CCOCC1)c1ccnc(NCc2cccnc2)c1
InChIInChI=1S/C22H23N5O2/c28-22(26-19-5-1-2-6-20(19)27-10-12-29-13-11-27)18-7-9-24-21(14-18)25-16-17-4-3-8-23-15-17/h1-9,14-15H,10-13,16H2,(H,24,25)(H,26,28)
InChIKeyKKNCQQGFVUSCSE-UHFFFAOYSA-N
XLogP3.18
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-bromophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171963
2-(2-methoxyethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide
CID 109166957
2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)pyridine-4-carboxamide
CID 109168044
N-(2,6-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171978
2-(pyridin-3-ylmethylamino)pyridine-4-carboxylic acid
CID 29037275
N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171976
N-(4-bromo-2-methylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171966
2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide
CID 109168802
2-N-cyclopropyl-4-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide
CID 109078752
6-methyl-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 18148178
1-(2-morpholin-4-ylphenyl)-3-pyrazin-2-ylurea
CID 110492463
N-[2-(azepan-1-yl)phenyl]pyridine-3-carboxamide
CID 38282179

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide (CID 109171960) is N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide is O=C(Nc1ccccc1N1CCOCC1)c1ccnc(NCc2cccnc2)c1.
What is the InChIKey of N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide?
The InChIKey is KKNCQQGFVUSCSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O2/c28-22(26-19-5-1-2-6-20(19)27-10-12-29-13-11-27)18-7-9-24-21(14-18)25-16-17-4-3-8-23-15-17/h1-9,14-15H,10-13,16H2,(H,24,25)(H,26,28).
What are the key properties of N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide?
N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 3.18, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide is sourced from PubChem (CID 109171960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).