N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide

C14H15N3O — CID 110857873

IUPACN-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide
SMILESCCN(C(=O)c1cnc(C)nc1)c1ccccc1
InChIInChI=1S/C14H15N3O/c1-3-17(13-7-5-4-6-8-13)14(18)12-9-15-11(2)16-10-12/h4-10H,3H2,1-2H3
InChIKeyBCXVHJDDWDXKEZ-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.45
Rot. Bonds3

About N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide

N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide (PubChem CID 110857873) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide
PubChem CID110857873
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide
SMILESCCN(C(=O)c1cnc(C)nc1)c1ccccc1
InChIInChI=1S/C14H15N3O/c1-3-17(13-7-5-4-6-8-13)14(18)12-9-15-11(2)16-10-12/h4-10H,3H2,1-2H3
InChIKeyBCXVHJDDWDXKEZ-UHFFFAOYSA-N
XLogP2.45
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-[(2-methylphenyl)methylamino]-N-phenylpyrimidine-5-carboxamide
CID 109255731
2-[butyl(methyl)amino]-N-ethyl-N-phenylpyrimidine-5-carboxamide
CID 109264001
2-(azepan-1-yl)-N-ethyl-N-phenylpyrimidine-5-carboxamide
CID 109264971
2-(cyclopropylamino)-N-ethyl-N-phenylpyrimidine-5-carboxamide
CID 109247558
N-ethyl-3,5-dimethyl-N-phenylbenzamide
CID 134028664
2-(3,4-dimethylanilino)-N-ethyl-N-phenylpyrimidine-5-carboxamide
CID 109266763
4-ethoxy-N-ethyl-N-phenylbenzamide
CID 721190
2-(4-acetylanilino)-N-ethyl-N-phenylpyrimidine-5-carboxamide
CID 109267607
N-ethyl-2-(3-methylbutylamino)-N-phenylpyrimidine-5-carboxamide
CID 109263537
N-ethyl-2-(N-ethylanilino)-N-(3-methylphenyl)pyrimidine-5-carboxamide
CID 109267707
N-ethyl-2-(2-fluoroanilino)-N-phenylpyrimidine-5-carboxamide
CID 109267578
N-ethyl-4-(2-phenoxyethoxy)-N-phenylbenzamide
CID 4952665

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide?
The IUPAC name of N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide (CID 110857873) is N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide.
What is the SMILES notation for N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide?
The canonical SMILES for N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide is CCN(C(=O)c1cnc(C)nc1)c1ccccc1.
What is the InChIKey of N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide?
The InChIKey is BCXVHJDDWDXKEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-3-17(13-7-5-4-6-8-13)14(18)12-9-15-11(2)16-10-12/h4-10H,3H2,1-2H3.
What are the key properties of N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide?
N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide has a molecular weight of 241.29 g/mol, XLogP of 2.45, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide is sourced from PubChem (CID 110857873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).