N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide

C18H26N2O2 — CID 95352258

IUPACN-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide
SMILESCc1ccccc1[C@H](NC(=O)CCN1CCCC1=O)C(C)C
InChIInChI=1S/C18H26N2O2/c1-13(2)18(15-8-5-4-7-14(15)3)19-16(21)10-12-20-11-6-9-17(20)22/h4-5,7-8,13,18H,6,9-12H2,1-3H3,(H,19,21)/t18-/m1/s1
InChIKeyWAORDJGJROLJIT-GOSISDBHSA-N
MW302.42 g/mol
LogP2.82
Rot. Bonds6

About N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide

N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide (PubChem CID 95352258) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide.

Molecular Properties

Compound NameN-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide
PubChem CID95352258
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC NameN-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide
SMILESCc1ccccc1[C@H](NC(=O)CCN1CCCC1=O)C(C)C
InChIInChI=1S/C18H26N2O2/c1-13(2)18(15-8-5-4-7-14(15)3)19-16(21)10-12-20-11-6-9-17(20)22/h4-5,7-8,13,18H,6,9-12H2,1-3H3,(H,19,21)/t18-/m1/s1
InChIKeyWAORDJGJROLJIT-GOSISDBHSA-N
XLogP2.82
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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N-[(2R)-1-hydroxy-1,1-diphenylpropan-2-yl]-3-(2-oxopyrrolidin-1-yl)propanamide
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4-(2-oxopyrrolidin-1-yl)-N-[(1R)-1-[2-(trifluoromethyl)phenyl]ethyl]butanamide
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N-[(S)-(2,5-dimethylphenyl)-pyridin-3-ylmethyl]-3-(2-oxopyrrolidin-1-yl)propanamide
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1-[(2R)-2-hydroxy-3-[[(1S)-1-(2-methylphenyl)ethyl]amino]propyl]pyrrolidin-2-one
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[2-(2,4-dimethylphenyl)-1-[3-(2-oxopiperidin-1-yl)propanoylamino]ethyl]boronic acid
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3-(2-oxopyrrolidin-1-yl)-N-(1-phenyl-2-pyrazol-1-ylethyl)propanamide
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N-(2-carbamothioylphenyl)-3-(2-oxopyrrolidin-1-yl)propanamide
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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide?
The IUPAC name of N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide (CID 95352258) is N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide.
What is the SMILES notation for N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide?
The canonical SMILES for N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide is Cc1ccccc1[C@H](NC(=O)CCN1CCCC1=O)C(C)C.
What is the InChIKey of N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide?
The InChIKey is WAORDJGJROLJIT-GOSISDBHSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-13(2)18(15-8-5-4-7-14(15)3)19-16(21)10-12-20-11-6-9-17(20)22/h4-5,7-8,13,18H,6,9-12H2,1-3H3,(H,19,21)/t18-/m1/s1.
What are the key properties of N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide?
N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide has a molecular weight of 302.42 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-methyl-1-(2-methylphenyl)propyl]-3-(2-oxopyrrolidin-1-yl)propanamide is sourced from PubChem (CID 95352258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).