N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide

C19H20N6O3 — CID 70704279

IUPACN-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide
SMILESCN(Cc1nc(-c2ccccc2)no1)C(=O)c1cnc(N2CCOCC2)nc1
InChIInChI=1S/C19H20N6O3/c1-24(13-16-22-17(23-28-16)14-5-3-2-4-6-14)18(26)15-11-20-19(21-12-15)25-7-9-27-10-8-25/h2-6,11-12H,7-10,13H2,1H3
InChIKeyKQFPVTPRSMCPQN-UHFFFAOYSA-N
MW380.41 g/mol
LogP1.64
Rot. Bonds5

About N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide

N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide (PubChem CID 70704279) has the molecular formula C19H20N6O3 and a molecular weight of 380.41 g/mol. Its IUPAC name is N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide
PubChem CID70704279
Molecular FormulaC19H20N6O3
Molecular Weight380.41 g/mol
Exact Mass380.16
IUPAC NameN-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide
SMILESCN(Cc1nc(-c2ccccc2)no1)C(=O)c1cnc(N2CCOCC2)nc1
InChIInChI=1S/C19H20N6O3/c1-24(13-16-22-17(23-28-16)14-5-3-2-4-6-14)18(26)15-11-20-19(21-12-15)25-7-9-27-10-8-25/h2-6,11-12H,7-10,13H2,1H3
InChIKeyKQFPVTPRSMCPQN-UHFFFAOYSA-N
XLogP1.64
TPSA97.48 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.41
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide with MolForge

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Related Compounds

4-methoxy-N-methyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 6461980
N,3,4-trimethyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 6462643
N-methyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 100706328
N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]-2-phenylpyrimidine-5-carboxamide
CID 95551014
3-(azocan-1-yl)-N-methyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]propanamide
CID 46982575
1-methyl-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylurea
CID 17275261
N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-N-prop-2-enylmorpholine-4-carboxamide
CID 6464157
N-[[3-(4-morpholin-4-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-phenylacetamide
CID 46296149
N-methyl-2-naphthalen-2-yloxy-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]acetamide
CID 8874641
N-methyl-1-methylsulfonyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-4-carboxamide
CID 50945556
N,3-dimethyl-N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]benzamide
CID 8835651
N-methyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenothiazine-10-carboxamide
CID 8875016

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide?
The IUPAC name of N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide (CID 70704279) is N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide.
What is the SMILES notation for N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide?
The canonical SMILES for N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide is CN(Cc1nc(-c2ccccc2)no1)C(=O)c1cnc(N2CCOCC2)nc1.
What is the InChIKey of N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide?
The InChIKey is KQFPVTPRSMCPQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O3/c1-24(13-16-22-17(23-28-16)14-5-3-2-4-6-14)18(26)15-11-20-19(21-12-15)25-7-9-27-10-8-25/h2-6,11-12H,7-10,13H2,1H3.
What are the key properties of N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide?
N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide has a molecular weight of 380.41 g/mol, XLogP of 1.64, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-morpholin-4-yl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-5-carboxamide is sourced from PubChem (CID 70704279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).