N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine

C16H18N4 — CID 62954974

IUPACN-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine
SMILESCCn1ccnc1CNc1cccc2ccc(C)nc12
InChIInChI=1S/C16H18N4/c1-3-20-10-9-17-15(20)11-18-14-6-4-5-13-8-7-12(2)19-16(13)14/h4-10,18H,3,11H2,1-2H3
InChIKeyOBNCFJWQGBUSOL-UHFFFAOYSA-N
MW266.35 g/mol
LogP3.37
Rot. Bonds4

About N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine

N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine (PubChem CID 62954974) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine.

Molecular Properties

Compound NameN-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine
PubChem CID62954974
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC NameN-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine
SMILESCCn1ccnc1CNc1cccc2ccc(C)nc12
InChIInChI=1S/C16H18N4/c1-3-20-10-9-17-15(20)11-18-14-6-4-5-13-8-7-12(2)19-16(13)14/h4-10,18H,3,11H2,1-2H3
InChIKeyOBNCFJWQGBUSOL-UHFFFAOYSA-N
XLogP3.37
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-ethylimidazol-2-yl)methyl]-2-methylpyridin-3-amine
CID 79041847
2-bromo-3-chloro-N-[(1-ethylimidazol-2-yl)methyl]aniline
CID 103478138
N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine
CID 55064680
N-[(2,6-difluorophenyl)methyl]-2-methylquinolin-8-amine
CID 62954438
2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine
CID 55154213
N-[(1-ethylimidazol-2-yl)methyl]-2-imidazol-1-ylaniline
CID 62355714
3-N-[(1-ethylimidazol-2-yl)methyl]-4-N,4-N-dimethylpyridine-3,4-diamine
CID 62355893
2-[(1-ethylimidazol-2-yl)methylamino]-N,N-dimethylbenzamide
CID 62351342
3-ethyl-N-[(1-ethylimidazol-2-yl)methyl]aniline
CID 62356031
3-[(1-ethylimidazol-2-yl)methylamino]-4-methylbenzonitrile
CID 62352424
N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine
CID 62356904
2-chloro-N-[(1-ethylimidazol-2-yl)methyl]-5-fluoroaniline
CID 113255916

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine?
The IUPAC name of N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine (CID 62954974) is N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine.
What is the SMILES notation for N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine?
The canonical SMILES for N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine is CCn1ccnc1CNc1cccc2ccc(C)nc12.
What is the InChIKey of N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine?
The InChIKey is OBNCFJWQGBUSOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-3-20-10-9-17-15(20)11-18-14-6-4-5-13-8-7-12(2)19-16(13)14/h4-10,18H,3,11H2,1-2H3.
What are the key properties of N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine?
N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine has a molecular weight of 266.35 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine is sourced from PubChem (CID 62954974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).