2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide

C19H23N3O2 — CID 656274

IUPAC2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide
SMILESCc1cc(NC(=O)C(C)C)ncc1NC(=O)CCc1ccccc1
InChIInChI=1S/C19H23N3O2/c1-13(2)19(24)22-17-11-14(3)16(12-20-17)21-18(23)10-9-15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3,(H,21,23)(H,20,22,24)
InChIKeyRHFDKYZOMLSGIY-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.56
Rot. Bonds6

About 2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide

2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide (PubChem CID 656274) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide
PubChem CID656274
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide
SMILESCc1cc(NC(=O)C(C)C)ncc1NC(=O)CCc1ccccc1
InChIInChI=1S/C19H23N3O2/c1-13(2)19(24)22-17-11-14(3)16(12-20-17)21-18(23)10-9-15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3,(H,21,23)(H,20,22,24)
InChIKeyRHFDKYZOMLSGIY-UHFFFAOYSA-N
XLogP3.56
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide?
The IUPAC name of 2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide (CID 656274) is 2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide.
What is the SMILES notation for 2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide?
The canonical SMILES for 2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide is Cc1cc(NC(=O)C(C)C)ncc1NC(=O)CCc1ccccc1.
What is the InChIKey of 2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide?
The InChIKey is RHFDKYZOMLSGIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-13(2)19(24)22-17-11-14(3)16(12-20-17)21-18(23)10-9-15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3,(H,21,23)(H,20,22,24).
What are the key properties of 2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide?
2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide has a molecular weight of 325.41 g/mol, XLogP of 3.56, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-methyl-5-(3-phenylpropanoylamino)-2-pyridinyl]propanamide is sourced from PubChem (CID 656274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).