2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide

C17H21N3O — CID 113023476

IUPAC2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide
SMILESCCCNc1ccc(NC(=O)Cc2cccc(C)c2)nc1
InChIInChI=1S/C17H21N3O/c1-3-9-18-15-7-8-16(19-12-15)20-17(21)11-14-6-4-5-13(2)10-14/h4-8,10,12,18H,3,9,11H2,1-2H3,(H,19,20,21)
InChIKeyMSXSWSYTFPTJGS-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.39
Rot. Bonds6

About 2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide

2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide (PubChem CID 113023476) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide
PubChem CID113023476
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide
SMILESCCCNc1ccc(NC(=O)Cc2cccc(C)c2)nc1
InChIInChI=1S/C17H21N3O/c1-3-9-18-15-7-8-16(19-12-15)20-17(21)11-14-6-4-5-13(2)10-14/h4-8,10,12,18H,3,9,11H2,1-2H3,(H,19,20,21)
InChIKeyMSXSWSYTFPTJGS-UHFFFAOYSA-N
XLogP3.39
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methylphenyl)-N-[4-(propylamino)phenyl]acetamide
CID 112979742
2-(3-methylphenyl)-N-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]acetamide
CID 113025662
2-(4-fluorophenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide
CID 113023449
N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113017495
2-(2-methylphenyl)-N-[5-[(3-methylphenyl)methylamino]-2-pyridinyl]acetamide
CID 113026630
N-[6-(4-tert-butylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113018155
2-(3-fluorophenyl)-N-[5-(3-methylanilino)-2-pyridinyl]acetamide
CID 113031460
N-[5-(propylamino)-2-pyridinyl]propanamide
CID 113023412
2-(3,4-dimethoxyphenyl)-N-[5-[(3-methylphenyl)methylamino]-2-pyridinyl]acetamide
CID 113026619
2-(4-methylphenyl)-N-[6-[(3-methylphenyl)methylamino]-3-pyridinyl]acetamide
CID 113011699
2-(4-methylphenyl)-N-[6-(propylamino)-3-pyridinyl]acetamide
CID 113009090
N-[6-(3,4-dichloroanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113022187

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide?
The IUPAC name of 2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide (CID 113023476) is 2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide.
What is the SMILES notation for 2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide?
The canonical SMILES for 2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide is CCCNc1ccc(NC(=O)Cc2cccc(C)c2)nc1.
What is the InChIKey of 2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide?
The InChIKey is MSXSWSYTFPTJGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-3-9-18-15-7-8-16(19-12-15)20-17(21)11-14-6-4-5-13(2)10-14/h4-8,10,12,18H,3,9,11H2,1-2H3,(H,19,20,21).
What are the key properties of 2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide?
2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide has a molecular weight of 283.38 g/mol, XLogP of 3.39, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide is sourced from PubChem (CID 113023476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).