N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide

C19H24N4O2 — CID 97338063

IUPACN-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide
SMILESCCN(CC)C(=O)[C@H](NC(=O)c1cnc(C)nc1C)c1ccccc1
InChIInChI=1S/C19H24N4O2/c1-5-23(6-2)19(25)17(15-10-8-7-9-11-15)22-18(24)16-12-20-14(4)21-13(16)3/h7-12,17H,5-6H2,1-4H3,(H,22,24)/t17-/m1/s1
InChIKeyDBHVFDREHCKOJW-QGZVFWFLSA-N
MW340.43 g/mol
LogP2.43
Rot. Bonds6

About N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide

N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide (PubChem CID 97338063) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide
PubChem CID97338063
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide
SMILESCCN(CC)C(=O)[C@H](NC(=O)c1cnc(C)nc1C)c1ccccc1
InChIInChI=1S/C19H24N4O2/c1-5-23(6-2)19(25)17(15-10-8-7-9-11-15)22-18(24)16-12-20-14(4)21-13(16)3/h7-12,17H,5-6H2,1-4H3,(H,22,24)/t17-/m1/s1
InChIKeyDBHVFDREHCKOJW-QGZVFWFLSA-N
XLogP2.43
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzhydryl-2,4-dimethylpyrimidine-5-carboxamide
CID 92648536
N-(2-hydroxy-1-phenylethyl)-2,4-dimethylpyrimidine-5-carboxamide
CID 110001315
N-[(1S)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,3-dimethylquinoxaline-6-carboxamide
CID 110306222
N-[(1S)-2-(diethylamino)-2-oxo-1-phenylethyl]-2-methylpropanamide
CID 110287067
2-(tert-butylamino)-N,N-diethyl-2-phenylacetamide
CID 11118885
N-[2-(diethylamino)-2-oxo-1-phenylethyl]quinoline-6-carboxamide
CID 142776250
ethyl 2-[[(1S)-2-(diethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoacetate
CID 110287113
N-[(1S)-2-(diethylamino)-2-oxo-1-phenylethyl]butanamide
CID 110287066
2,4-dimethyl-N-[(2R)-pentan-2-yl]pyrimidine-5-carboxamide
CID 92648513
N-[(1R)-3-imidazol-1-yl-1-phenylpropyl]-2,4-dimethylpyrimidine-5-carboxamide
CID 92611687
N-benzyl-2,4-dimethylpyrimidine-5-carboxamide
CID 53007173
(2S)-N,N-diethyl-2-phenyl-2-(phenylcarbamoylamino)acetamide
CID 110287102

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide?
The IUPAC name of N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide (CID 97338063) is N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide.
What is the SMILES notation for N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide?
The canonical SMILES for N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide is CCN(CC)C(=O)[C@H](NC(=O)c1cnc(C)nc1C)c1ccccc1.
What is the InChIKey of N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide?
The InChIKey is DBHVFDREHCKOJW-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-5-23(6-2)19(25)17(15-10-8-7-9-11-15)22-18(24)16-12-20-14(4)21-13(16)3/h7-12,17H,5-6H2,1-4H3,(H,22,24)/t17-/m1/s1.
What are the key properties of N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide?
N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]-2,4-dimethylpyrimidine-5-carboxamide is sourced from PubChem (CID 97338063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).