2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide

C18H23N3O — CID 113024145

IUPAC2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide
SMILESCc1ccccc1CC(=O)Nc1ccc(NCC(C)C)cn1
InChIInChI=1S/C18H23N3O/c1-13(2)11-19-16-8-9-17(20-12-16)21-18(22)10-15-7-5-4-6-14(15)3/h4-9,12-13,19H,10-11H2,1-3H3,(H,20,21,22)
InChIKeyYDMOWKYRDWGBIT-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.64
Rot. Bonds6

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

2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide (PubChem CID 113024145) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide
PubChem CID113024145
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC Name2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide
SMILESCc1ccccc1CC(=O)Nc1ccc(NCC(C)C)cn1
InChIInChI=1S/C18H23N3O/c1-13(2)11-19-16-8-9-17(20-12-16)21-18(22)10-15-7-5-4-6-14(15)3/h4-9,12-13,19H,10-11H2,1-3H3,(H,20,21,22)
InChIKeyYDMOWKYRDWGBIT-UHFFFAOYSA-N
XLogP3.64
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-(butan-2-ylamino)-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113024277
2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide
CID 113026479
N-[5-(2-methylanilino)-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113031347
N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide
CID 113026477
N-[6-(tert-butylamino)-3-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113014815
2-(2-fluorophenyl)-N-[6-(2-methylpropylamino)-3-pyridinyl]acetamide
CID 113009631
N-[5-(cyclopropylamino)-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113023745
2-(2-methylphenyl)-N-[5-(3-phenylpropylamino)-2-pyridinyl]acetamide
CID 113029843
2-(2-methylphenyl)-N-[5-[(3-methylphenyl)methylamino]-2-pyridinyl]acetamide
CID 113026630
N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide
CID 56784483
N-[5-[(4-methoxyphenyl)methylamino]-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113027443
N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)acetamide
CID 6464449

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide?
The IUPAC name of 2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide (CID 113024145) is 2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide.
What is the SMILES notation for 2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide?
The canonical SMILES for 2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide is Cc1ccccc1CC(=O)Nc1ccc(NCC(C)C)cn1.
What is the InChIKey of 2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide?
The InChIKey is YDMOWKYRDWGBIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O/c1-13(2)11-19-16-8-9-17(20-12-16)21-18(22)10-15-7-5-4-6-14(15)3/h4-9,12-13,19H,10-11H2,1-3H3,(H,20,21,22).
What are the key properties of 2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide?
2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide has a molecular weight of 297.40 g/mol, XLogP of 3.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide is sourced from PubChem (CID 113024145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).