N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide

C14H17N3O2 — CID 119061251

IUPACN-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide
SMILESCOc1ccc2c(C(=O)NCCN)cc(C)nc2c1
InChIInChI=1S/C14H17N3O2/c1-9-7-12(14(18)16-6-5-15)11-4-3-10(19-2)8-13(11)17-9/h3-4,7-8H,5-6,15H2,1-2H3,(H,16,18)
InChIKeySSNBBDFMSKXYDG-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.24
Rot. Bonds4

About N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide

N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide (PubChem CID 119061251) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide
PubChem CID119061251
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide
SMILESCOc1ccc2c(C(=O)NCCN)cc(C)nc2c1
InChIInChI=1S/C14H17N3O2/c1-9-7-12(14(18)16-6-5-15)11-4-3-10(19-2)8-13(11)17-9/h3-4,7-8H,5-6,15H2,1-2H3,(H,16,18)
InChIKeySSNBBDFMSKXYDG-UHFFFAOYSA-N
XLogP1.24
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-methoxy-2-methyl-N-(4-pyrrolidin-1-ylbutyl)quinoline-4-carboxamide
CID 118780364
7-methoxy-2-methyl-N-[(3-methyloxetan-3-yl)methyl]quinoline-4-carboxamide
CID 119059354
7-methoxy-2-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]quinoline-4-carboxamide
CID 119071112
N-(2-aminoethyl)-4-methoxy-2-methylbenzamide;hydrochloride
CID 119384390
N-[(4-methoxyphenyl)methyl]-2-methylquinoline-4-carboxamide
CID 7959679
7-methoxy-2-methylquinoline-4-carboximidamide
CID 82573492
N-[2-[(1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hexan-2-yl]-2-oxoethyl]-7-methoxy-2-methylquinoline-4-carboxamide
CID 170539763
N-(1-imidazol-1-yl-3,3-dimethylbutan-2-yl)-7-methoxy-2-methylquinoline-4-carboxamide
CID 131905635
methyl 3-(7-methoxy-2-methylquinolin-4-yl)propanoate
CID 82578206
6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide
CID 110489408
N-[2-(3,4-dimethoxyphenyl)ethyl]-7-fluoro-2-methylquinoline-4-carboxamide
CID 46422325
N-(3-hydroxypropyl)-7-methoxy-2-methylquinoline-3-carboxamide
CID 78854787

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide?
The IUPAC name of N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide (CID 119061251) is N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide is COc1ccc2c(C(=O)NCCN)cc(C)nc2c1.
What is the InChIKey of N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide?
The InChIKey is SSNBBDFMSKXYDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-9-7-12(14(18)16-6-5-15)11-4-3-10(19-2)8-13(11)17-9/h3-4,7-8H,5-6,15H2,1-2H3,(H,16,18).
What are the key properties of N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide?
N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide is sourced from PubChem (CID 119061251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).