N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide

C19H17N3O — CID 1470760

IUPACN,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide
SMILESCN(C)C(=O)c1cnc(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C19H17N3O/c1-22(2)19(23)16-13-20-18(15-11-7-4-8-12-15)21-17(16)14-9-5-3-6-10-14/h3-13H,1-2H3
InChIKeyCVOYMCJQERIMOL-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.51
Rot. Bonds3

About N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide

N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide (PubChem CID 1470760) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide
PubChem CID1470760
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC NameN,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide
SMILESCN(C)C(=O)c1cnc(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C19H17N3O/c1-22(2)19(23)16-13-20-18(15-11-7-4-8-12-15)21-17(16)14-9-5-3-6-10-14/h3-13H,1-2H3
InChIKeyCVOYMCJQERIMOL-UHFFFAOYSA-N
XLogP3.51
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide?
The IUPAC name of N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide (CID 1470760) is N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide.
What is the SMILES notation for N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide?
The canonical SMILES for N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide is CN(C)C(=O)c1cnc(-c2ccccc2)nc1-c1ccccc1.
What is the InChIKey of N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide?
The InChIKey is CVOYMCJQERIMOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c1-22(2)19(23)16-13-20-18(15-11-7-4-8-12-15)21-17(16)14-9-5-3-6-10-14/h3-13H,1-2H3.
What are the key properties of N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide?
N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 3.51, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2,4-diphenylpyrimidine-5-carboxamide is sourced from PubChem (CID 1470760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).