N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide

C21H23N3O2 — CID 73056477

IUPACN-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide
SMILESCCOc1ccccc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
InChIInChI=1S/C21H23N3O2/c1-3-26-20-7-5-4-6-15(20)8-11-21(25)24-16-9-10-19-17(13-16)18(22)12-14(2)23-19/h4-7,9-10,12-13H,3,8,11H2,1-2H3,(H2,22,23)(H,24,25)
InChIKeyDAUOFACYVCSTFD-UHFFFAOYSA-N
MW349.43 g/mol
LogP4.10
Rot. Bonds6

About N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide

N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide (PubChem CID 73056477) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide.

Molecular Properties

Compound NameN-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide
PubChem CID73056477
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC NameN-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide
SMILESCCOc1ccccc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
InChIInChI=1S/C21H23N3O2/c1-3-26-20-7-5-4-6-15(20)8-11-21(25)24-16-9-10-19-17(13-16)18(22)12-14(2)23-19/h4-7,9-10,12-13H,3,8,11H2,1-2H3,(H2,22,23)(H,24,25)
InChIKeyDAUOFACYVCSTFD-UHFFFAOYSA-N
XLogP4.10
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-amino-2-methylquinolin-6-yl)-3-[2-(trifluoromethyl)phenyl]propanamide
CID 73056183
N-(4-amino-2-methylquinolin-6-yl)-3-(3-methoxythiophen-2-yl)propanamide
CID 73056775
N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide
CID 22083450
N-(3-acetamido-4-fluorophenyl)-3-(2-ethoxyphenyl)propanamide
CID 32943090
N-[6-(dimethylamino)-3-pyridinyl]-3-(2-ethoxyphenyl)propanamide
CID 30295210
N-(4-amino-2-methylquinolin-6-yl)-2-benzylbenzamide
CID 10546941
N-[(2-ethoxyphenyl)methyl]-N'-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide
CID 122174501
1,3-bis(4-amino-2-methylquinolin-6-yl)urea;hydron;dichloride
CID 67107964
3-(2-aminophenyl)-N-(2-methyl-4-pyridinyl)propanamide
CID 79240805
N-(4-amino-2-methylquinolin-6-yl)-2-(4-phenylbutyl)benzamide;hydrochloride
CID 162308221
1,3-bis(4-amino-2-methylquinolin-6-yl)urea;urea;hydrochloride
CID 89405609
N-[3-[3-(2-ethoxyphenyl)propanoylamino]phenyl]furan-2-carboxamide
CID 32708292

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide?
The IUPAC name of N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide (CID 73056477) is N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide.
What is the SMILES notation for N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide?
The canonical SMILES for N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide is CCOc1ccccc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1.
What is the InChIKey of N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide?
The InChIKey is DAUOFACYVCSTFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2/c1-3-26-20-7-5-4-6-15(20)8-11-21(25)24-16-9-10-19-17(13-16)18(22)12-14(2)23-19/h4-7,9-10,12-13H,3,8,11H2,1-2H3,(H2,22,23)(H,24,25).
What are the key properties of N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide?
N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide has a molecular weight of 349.43 g/mol, XLogP of 4.10, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methylquinolin-6-yl)-3-(2-ethoxyphenyl)propanamide is sourced from PubChem (CID 73056477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).