N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide

C19H27N3O2 — CID 8593716

IUPACN-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide
SMILESC[C@@H]1CCc2ccccc2N1CC(=O)NC(=O)NC1CCCCC1
InChIInChI=1S/C19H27N3O2/c1-14-11-12-15-7-5-6-10-17(15)22(14)13-18(23)21-19(24)20-16-8-3-2-4-9-16/h5-7,10,14,16H,2-4,8-9,11-13H2,1H3,(H2,20,21,23,24)/t14-/m1/s1
InChIKeyNTFMSYFBJARRCP-CQSZACIVSA-N
MW329.44 g/mol
LogP2.99
Rot. Bonds3

About N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide

N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide (PubChem CID 8593716) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide.

Molecular Properties

Compound NameN-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide
PubChem CID8593716
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC NameN-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide
SMILESC[C@@H]1CCc2ccccc2N1CC(=O)NC(=O)NC1CCCCC1
InChIInChI=1S/C19H27N3O2/c1-14-11-12-15-7-5-6-10-17(15)22(14)13-18(23)21-19(24)20-16-8-3-2-4-9-16/h5-7,10,14,16H,2-4,8-9,11-13H2,1H3,(H2,20,21,23,24)/t14-/m1/s1
InChIKeyNTFMSYFBJARRCP-CQSZACIVSA-N
XLogP2.99
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopentylcarbamoyl)-2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)acetamide
CID 46802249
2-[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-N-(propylcarbamoyl)acetamide
CID 8724601
N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 22200030
N-(cyclopentylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide
CID 51170796
N-cyclohexyl-2-(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)acetamide
CID 22198947
2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-1-pyrrolidin-1-ylethanone
CID 162353371
methyl 2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)acetate
CID 43089229
2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 8593706
N-(4-methoxyphenyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide
CID 8724702
N-(cyclopentylcarbamoyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide
CID 8896823
N-cyclopropyl-3-[[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)acetyl]amino]benzamide
CID 24566735
N-(2-aminophenyl)-2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)acetamide
CID 18069905

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide?
The IUPAC name of N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide (CID 8593716) is N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide.
What is the SMILES notation for N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide?
The canonical SMILES for N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide is C[C@@H]1CCc2ccccc2N1CC(=O)NC(=O)NC1CCCCC1.
What is the InChIKey of N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide?
The InChIKey is NTFMSYFBJARRCP-CQSZACIVSA-N. The full InChI is InChI=1S/C19H27N3O2/c1-14-11-12-15-7-5-6-10-17(15)22(14)13-18(23)21-19(24)20-16-8-3-2-4-9-16/h5-7,10,14,16H,2-4,8-9,11-13H2,1H3,(H2,20,21,23,24)/t14-/m1/s1.
What are the key properties of N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide?
N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide has a molecular weight of 329.44 g/mol, XLogP of 2.99, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylcarbamoyl)-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide is sourced from PubChem (CID 8593716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).