N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide

C19H17N5O4 — CID 44782857

IUPACN-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide
SMILESO=C(Nc1cnc2ccc(C(=O)N3CCOCC3)cn2c1=O)c1cccnc1
InChIInChI=1S/C19H17N5O4/c25-17(13-2-1-5-20-10-13)22-15-11-21-16-4-3-14(12-24(16)19(15)27)18(26)23-6-8-28-9-7-23/h1-5,10-12H,6-9H2,(H,22,25)
InChIKeyMKAUNHHZULJQCV-UHFFFAOYSA-N
MW379.38 g/mol
LogP0.81
Rot. Bonds3

About N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide

N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide (PubChem CID 44782857) has the molecular formula C19H17N5O4 and a molecular weight of 379.38 g/mol. Its IUPAC name is N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide
PubChem CID44782857
Molecular FormulaC19H17N5O4
Molecular Weight379.38 g/mol
Exact Mass379.13
IUPAC NameN-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide
SMILESO=C(Nc1cnc2ccc(C(=O)N3CCOCC3)cn2c1=O)c1cccnc1
InChIInChI=1S/C19H17N5O4/c25-17(13-2-1-5-20-10-13)22-15-11-21-16-4-3-14(12-24(16)19(15)27)18(26)23-6-8-28-9-7-23/h1-5,10-12H,6-9H2,(H,22,25)
InChIKeyMKAUNHHZULJQCV-UHFFFAOYSA-N
XLogP0.81
TPSA105.90 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.38
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-fluoro-N-[9-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]benzamide
CID 44782939
N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide
CID 24676967
[4-(2-morpholin-4-ylethyl)piperazin-1-yl]-pyridin-3-ylmethanone
CID 113073695
N-[4-(4-methylpiperazine-1-carbonyl)phenyl]pyridine-3-carboxamide
CID 94646302
4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide
CID 136527988
N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)pyridine-3-carboxamide
CID 17173598
N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide
CID 142611651
N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 6473397
N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 1081261
morpholin-4-yl-[4-[3-(2-pyridin-3-ylethynyl)imidazo[1,2-b]pyridazin-6-yl]phenyl]methanone
CID 118000489
morpholin-4-yl(pyridazin-4-yl)methanone
CID 115736040
N-[2-(4-morpholin-4-ylbutanoyl)phenyl]pyridine-3-carboxamide
CID 157132607

Frequently Asked Questions

What is the IUPAC name of N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide?
The IUPAC name of N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide (CID 44782857) is N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide is O=C(Nc1cnc2ccc(C(=O)N3CCOCC3)cn2c1=O)c1cccnc1.
What is the InChIKey of N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide?
The InChIKey is MKAUNHHZULJQCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O4/c25-17(13-2-1-5-20-10-13)22-15-11-21-16-4-3-14(12-24(16)19(15)27)18(26)23-6-8-28-9-7-23/h1-5,10-12H,6-9H2,(H,22,25).
What are the key properties of N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide?
N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide has a molecular weight of 379.38 g/mol, XLogP of 0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]pyridine-3-carboxamide is sourced from PubChem (CID 44782857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).