N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide

C19H23N5O2 — CID 122356253

IUPACN-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCc1nc(N(C)C)nc(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
InChIInChI=1S/C19H23N5O2/c1-12-17(13(2)21-19(20-12)23(3)4)22-18(26)14-10-16(25)24(11-14)15-8-6-5-7-9-15/h5-9,14H,10-11H2,1-4H3,(H,22,26)
InChIKeyHNPGKNUWBSFQBE-UHFFFAOYSA-N
MW353.43 g/mol
LogP2.15
Rot. Bonds4

About N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide

N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide (PubChem CID 122356253) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
PubChem CID122356253
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC NameN-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCc1nc(N(C)C)nc(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1
InChIInChI=1S/C19H23N5O2/c1-12-17(13(2)21-19(20-12)23(3)4)22-18(26)14-10-16(25)24(11-14)15-8-6-5-7-9-15/h5-9,14H,10-11H2,1-4H3,(H,22,26)
InChIKeyHNPGKNUWBSFQBE-UHFFFAOYSA-N
XLogP2.15
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 122356256
N-[4-(dimethylamino)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 3109767
(3S)-5-oxo-1-phenyl-N-pyridin-4-ylpyrrolidine-3-carboxamide
CID 40500966
N-[4-(dimethylamino)-2-methoxypyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 122319413
(3S)-N-(2,6-dimethylphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 680417
(3S)-N,N-dimethyl-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 9350614
(3S)-N-(1H-benzimidazol-2-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 42234783
(3R)-N-(1,3-benzothiazol-2-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 1088299
N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 46266860
(3R)-N-(4-iodophenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 1286852
5-oxo-1-phenyl-N-(4-piperidin-1-ylphenyl)pyrrolidine-3-carboxamide
CID 46422723
(3R)-5-oxo-1-phenyl-N-(2-phenylpyrimidin-5-yl)pyrrolidine-3-carboxamide
CID 51937891

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The IUPAC name of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide (CID 122356253) is N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide is Cc1nc(N(C)C)nc(C)c1NC(=O)C1CC(=O)N(c2ccccc2)C1.
What is the InChIKey of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The InChIKey is HNPGKNUWBSFQBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-12-17(13(2)21-19(20-12)23(3)4)22-18(26)14-10-16(25)24(11-14)15-8-6-5-7-9-15/h5-9,14H,10-11H2,1-4H3,(H,22,26).
What are the key properties of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide has a molecular weight of 353.43 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-5-oxo-1-phenylpyrrolidine-3-carboxamide is sourced from PubChem (CID 122356253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).