2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide

C16H18N4O2 — CID 109365407

IUPAC2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide
SMILESCc1nc(C(=O)Nc2ccccc2)cc(N2CCOCC2)n1
InChIInChI=1S/C16H18N4O2/c1-12-17-14(16(21)19-13-5-3-2-4-6-13)11-15(18-12)20-7-9-22-10-8-20/h2-6,11H,7-10H2,1H3,(H,19,21)
InChIKeyPYZCYQZVRPQLLX-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.87
Rot. Bonds3

About 2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide

2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide (PubChem CID 109365407) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is 2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide
PubChem CID109365407
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC Name2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide
SMILESCc1nc(C(=O)Nc2ccccc2)cc(N2CCOCC2)n1
InChIInChI=1S/C16H18N4O2/c1-12-17-14(16(21)19-13-5-3-2-4-6-13)11-15(18-12)20-7-9-22-10-8-20/h2-6,11H,7-10H2,1H3,(H,19,21)
InChIKeyPYZCYQZVRPQLLX-UHFFFAOYSA-N
XLogP1.87
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-dichlorophenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365492
N-(2,6-dimethylphenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365418
2-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylphenyl)pyrimidine-4-carboxamide
CID 109365473
N-(4-ethoxyphenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365450
N-(2-bromophenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365478
2-methyl-N-[4-(4-methylpiperidin-1-yl)phenyl]-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365472
N-(2-methoxyphenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365446
methyl 2-[(2-methyl-6-morpholin-4-ylpyrimidine-4-carbonyl)amino]benzoate
CID 109365464
N-(2,3-dichlorophenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365497
2-methyl-6-pyrrolidin-1-yl-N-(4-pyrrolidin-1-ylphenyl)pyrimidine-4-carboxamide
CID 109362838
N-(3,5-dimethylphenyl)-6-morpholin-4-yl-2-phenylpyrimidine-4-carboxamide
CID 112853445
N-(2,4-dichlorophenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365493

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide?
The IUPAC name of 2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide (CID 109365407) is 2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide.
What is the SMILES notation for 2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide?
The canonical SMILES for 2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide is Cc1nc(C(=O)Nc2ccccc2)cc(N2CCOCC2)n1.
What is the InChIKey of 2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide?
The InChIKey is PYZCYQZVRPQLLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c1-12-17-14(16(21)19-13-5-3-2-4-6-13)11-15(18-12)20-7-9-22-10-8-20/h2-6,11H,7-10H2,1H3,(H,19,21).
What are the key properties of 2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide?
2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide is sourced from PubChem (CID 109365407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).