N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide

C18H26N2O2 — CID 56793889

IUPACN-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide
SMILESCC(C)c1ccc(CCC(=O)N(C)C2CCN(C)C2=O)cc1
InChIInChI=1S/C18H26N2O2/c1-13(2)15-8-5-14(6-9-15)7-10-17(21)20(4)16-11-12-19(3)18(16)22/h5-6,8-9,13,16H,7,10-12H2,1-4H3
InChIKeyDZIDLGKLTHCHAK-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.43
Rot. Bonds5

About N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide

N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide (PubChem CID 56793889) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound NameN-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide
PubChem CID56793889
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC NameN-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide
SMILESCC(C)c1ccc(CCC(=O)N(C)C2CCN(C)C2=O)cc1
InChIInChI=1S/C18H26N2O2/c1-13(2)15-8-5-14(6-9-15)7-10-17(21)20(4)16-11-12-19(3)18(16)22/h5-6,8-9,13,16H,7,10-12H2,1-4H3
InChIKeyDZIDLGKLTHCHAK-UHFFFAOYSA-N
XLogP2.43
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide?
The IUPAC name of N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide (CID 56793889) is N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide.
What is the SMILES notation for N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide?
The canonical SMILES for N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide is CC(C)c1ccc(CCC(=O)N(C)C2CCN(C)C2=O)cc1.
What is the InChIKey of N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide?
The InChIKey is DZIDLGKLTHCHAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-13(2)15-8-5-14(6-9-15)7-10-17(21)20(4)16-11-12-19(3)18(16)22/h5-6,8-9,13,16H,7,10-12H2,1-4H3.
What are the key properties of N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide?
N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide has a molecular weight of 302.42 g/mol, XLogP of 2.43, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)-3-(4-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 56793889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).