2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide

C19H24N2O — CID 6612586

IUPAC2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide
SMILESCc1cccnc1NC(=O)C(C)c1ccc(CC(C)C)cc1
InChIInChI=1S/C19H24N2O/c1-13(2)12-16-7-9-17(10-8-16)15(4)19(22)21-18-14(3)6-5-11-20-18/h5-11,13,15H,12H2,1-4H3,(H,20,21,22)
InChIKeyZBKGVYYUEQPQPO-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.33
Rot. Bonds5

About 2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide

2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide (PubChem CID 6612586) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide.

Molecular Properties

Compound Name2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide
PubChem CID6612586
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide
SMILESCc1cccnc1NC(=O)C(C)c1ccc(CC(C)C)cc1
InChIInChI=1S/C19H24N2O/c1-13(2)12-16-7-9-17(10-8-16)15(4)19(22)21-18-14(3)6-5-11-20-18/h5-11,13,15H,12H2,1-4H3,(H,20,21,22)
InChIKeyZBKGVYYUEQPQPO-UHFFFAOYSA-N
XLogP4.33
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide?
The IUPAC name of 2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide (CID 6612586) is 2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide.
What is the SMILES notation for 2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide?
The canonical SMILES for 2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide is Cc1cccnc1NC(=O)C(C)c1ccc(CC(C)C)cc1.
What is the InChIKey of 2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide?
The InChIKey is ZBKGVYYUEQPQPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-13(2)12-16-7-9-17(10-8-16)15(4)19(22)21-18-14(3)6-5-11-20-18/h5-11,13,15H,12H2,1-4H3,(H,20,21,22).
What are the key properties of 2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide?
2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide has a molecular weight of 296.41 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methylpropyl)phenyl]-N-(3-methyl-2-pyridinyl)propanamide is sourced from PubChem (CID 6612586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).