N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide

C18H25N3O — CID 133405225

IUPACN-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide
SMILESCCCc1cc(NCC(=O)NCC(C)C)c2ccccc2n1
InChIInChI=1S/C18H25N3O/c1-4-7-14-10-17(15-8-5-6-9-16(15)21-14)19-12-18(22)20-11-13(2)3/h5-6,8-10,13H,4,7,11-12H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyOLZVXEWCSQJLPL-UHFFFAOYSA-N
MW299.42 g/mol
LogP3.37
Rot. Bonds7

About N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide

N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide (PubChem CID 133405225) has the molecular formula C18H25N3O and a molecular weight of 299.42 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide
PubChem CID133405225
Molecular FormulaC18H25N3O
Molecular Weight299.42 g/mol
Exact Mass299.20
IUPAC NameN-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide
SMILESCCCc1cc(NCC(=O)NCC(C)C)c2ccccc2n1
InChIInChI=1S/C18H25N3O/c1-4-7-14-10-17(15-8-5-6-9-16(15)21-14)19-12-18(22)20-11-13(2)3/h5-6,8-10,13H,4,7,11-12H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyOLZVXEWCSQJLPL-UHFFFAOYSA-N
XLogP3.37
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.42
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-2-[(2-propylquinolin-4-yl)amino]acetamide
CID 133441654
3-[(2-propylquinolin-4-yl)amino]propanoic acid
CID 122048260
2-(2-ethylanilino)-N-(2-methylpropyl)acetamide
CID 28583341
2-(1,3-benzothiazol-2-ylamino)-N-(2-methylpropyl)acetamide
CID 113219085
N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide
CID 49226597
2-anilino-N-(2-methylpropyl)acetamide
CID 28565172
N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine
CID 133405257
N-(2-methylpropyl)-2-(2-propan-2-ylanilino)acetamide
CID 28573972
2-N-methyl-1-N-(2-pentylquinolin-4-yl)-2-N-phenylpropane-1,2-diamine
CID 166383106
5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol
CID 133402239
N-[(3-methyl-4-methylsulfonylphenyl)methyl]-2-propylquinolin-4-amine
CID 133412585
4-[2-(dimethylamino)propylamino]quinoline-2-carboxylic acid
CID 63377739

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide?
The IUPAC name of N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide (CID 133405225) is N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide?
The canonical SMILES for N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide is CCCc1cc(NCC(=O)NCC(C)C)c2ccccc2n1.
What is the InChIKey of N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide?
The InChIKey is OLZVXEWCSQJLPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O/c1-4-7-14-10-17(15-8-5-6-9-16(15)21-14)19-12-18(22)20-11-13(2)3/h5-6,8-10,13H,4,7,11-12H2,1-3H3,(H,19,21)(H,20,22).
What are the key properties of N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide?
N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide has a molecular weight of 299.42 g/mol, XLogP of 3.37, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide is sourced from PubChem (CID 133405225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).