N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide

C19H24N4O2 — CID 155233546

IUPACN-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide
SMILESCc1nc(N2CCCC2)[nH]c(=O)c1CCC(=O)N(C)c1ccccc1
InChIInChI=1S/C19H24N4O2/c1-14-16(18(25)21-19(20-14)23-12-6-7-13-23)10-11-17(24)22(2)15-8-4-3-5-9-15/h3-5,8-9H,6-7,10-13H2,1-2H3,(H,20,21,25)
InChIKeyCRQNSHREANGJJZ-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.27
Rot. Bonds5

About N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide

N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide (PubChem CID 155233546) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide.

Molecular Properties

Compound NameN-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide
PubChem CID155233546
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide
SMILESCc1nc(N2CCCC2)[nH]c(=O)c1CCC(=O)N(C)c1ccccc1
InChIInChI=1S/C19H24N4O2/c1-14-16(18(25)21-19(20-14)23-12-6-7-13-23)10-11-17(24)22(2)15-8-4-3-5-9-15/h3-5,8-9H,6-7,10-13H2,1-2H3,(H,20,21,25)
InChIKeyCRQNSHREANGJJZ-UHFFFAOYSA-N
XLogP2.27
TPSA69.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide?
The IUPAC name of N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide (CID 155233546) is N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide.
What is the SMILES notation for N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide?
The canonical SMILES for N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide is Cc1nc(N2CCCC2)[nH]c(=O)c1CCC(=O)N(C)c1ccccc1.
What is the InChIKey of N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide?
The InChIKey is CRQNSHREANGJJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-14-16(18(25)21-19(20-14)23-12-6-7-13-23)10-11-17(24)22(2)15-8-4-3-5-9-15/h3-5,8-9H,6-7,10-13H2,1-2H3,(H,20,21,25).
What are the key properties of N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide?
N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide has a molecular weight of 340.43 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(4-methyl-6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-5-yl)-N-phenylpropanamide is sourced from PubChem (CID 155233546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).