N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide

C22H24N4O2 — CID 97133707

IUPACN-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide
SMILESCN(C)C[C@@H](c1ccccc1)N(C)C(=O)c1cnc(-c2ccccc2)[nH]c1=O
InChIInChI=1S/C22H24N4O2/c1-25(2)15-19(16-10-6-4-7-11-16)26(3)22(28)18-14-23-20(24-21(18)27)17-12-8-5-9-13-17/h4-14,19H,15H2,1-3H3,(H,23,24,27)/t19-/m0/s1
InChIKeyBVZGWOYEGADNSR-IBGZPJMESA-N
MW376.46 g/mol
LogP2.81
Rot. Bonds6

About N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide

N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide (PubChem CID 97133707) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide
PubChem CID97133707
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC NameN-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide
SMILESCN(C)C[C@@H](c1ccccc1)N(C)C(=O)c1cnc(-c2ccccc2)[nH]c1=O
InChIInChI=1S/C22H24N4O2/c1-25(2)15-19(16-10-6-4-7-11-16)26(3)22(28)18-14-23-20(24-21(18)27)17-12-8-5-9-13-17/h4-14,19H,15H2,1-3H3,(H,23,24,27)/t19-/m0/s1
InChIKeyBVZGWOYEGADNSR-IBGZPJMESA-N
XLogP2.81
TPSA69.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide with MolForge

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Related Compounds

N-[2-(dimethylamino)-1-phenylethyl]-N-methylbenzamide
CID 91054783
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CID 70715770
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CID 70711569
N-[(3S)-3-hydroxy-3-phenylpropyl]-N-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidine-5-carboxamide
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N-methyl-2-(4-methylphenyl)-6-oxo-N-[(1R)-1-(1,3-thiazol-2-yl)ethyl]-1H-pyrimidine-5-carboxamide
CID 97116459
N-(2-ethylphenyl)-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide
CID 92648612
N-[2-(dimethylamino)-1-phenylethyl]-N,8-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 166293123
N-[2-(dimethylamino)-1-phenylethyl]-3-ethyl-N-methyl-1H-indole-2-carboxamide
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5-(4-methylpiperazine-1-carbonyl)-2-phenyl-1H-pyrimidin-6-one
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(1S)-N,N,N',N'-tetramethyl-1-phenylethane-1,2-diamine
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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide?
The IUPAC name of N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide (CID 97133707) is N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide?
The canonical SMILES for N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide is CN(C)C[C@@H](c1ccccc1)N(C)C(=O)c1cnc(-c2ccccc2)[nH]c1=O.
What is the InChIKey of N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide?
The InChIKey is BVZGWOYEGADNSR-IBGZPJMESA-N. The full InChI is InChI=1S/C22H24N4O2/c1-25(2)15-19(16-10-6-4-7-11-16)26(3)22(28)18-14-23-20(24-21(18)27)17-12-8-5-9-13-17/h4-14,19H,15H2,1-3H3,(H,23,24,27)/t19-/m0/s1.
What are the key properties of N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide?
N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-(dimethylamino)-1-phenylethyl]-N-methyl-6-oxo-2-phenyl-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 97133707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).