1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine

C16H18N4 — CID 62875579

IUPAC1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine
SMILESCCn1ccnc1C(NC)c1cccc2cccnc12
InChIInChI=1S/C16H18N4/c1-3-20-11-10-19-16(20)15(17-2)13-8-4-6-12-7-5-9-18-14(12)13/h4-11,15,17H,3H2,1-2H3
InChIKeyJFYUMFOWLPCXJW-UHFFFAOYSA-N
MW266.35 g/mol
LogP2.76
Rot. Bonds4

About 1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine

1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine (PubChem CID 62875579) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine.

Molecular Properties

Compound Name1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine
PubChem CID62875579
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine
SMILESCCn1ccnc1C(NC)c1cccc2cccnc12
InChIInChI=1S/C16H18N4/c1-3-20-11-10-19-16(20)15(17-2)13-8-4-6-12-7-5-9-18-14(12)13/h4-11,15,17H,3H2,1-2H3
InChIKeyJFYUMFOWLPCXJW-UHFFFAOYSA-N
XLogP2.76
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 ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine?
The IUPAC name of 1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine (CID 62875579) is 1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine.
What is the SMILES notation for 1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine?
The canonical SMILES for 1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine is CCn1ccnc1C(NC)c1cccc2cccnc12.
What is the InChIKey of 1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine?
The InChIKey is JFYUMFOWLPCXJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-3-20-11-10-19-16(20)15(17-2)13-8-4-6-12-7-5-9-18-14(12)13/h4-11,15,17H,3H2,1-2H3.
What are the key properties of 1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine?
1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine has a molecular weight of 266.35 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine is sourced from PubChem (CID 62875579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).