N-methyl-2-quinolin-5-ylcyclohexan-1-amine

C16H20N2 — CID 81224622

IUPACN-methyl-2-quinolin-5-ylcyclohexan-1-amine
SMILESCNC1CCCCC1c1cccc2ncccc12
InChIInChI=1S/C16H20N2/c1-17-15-9-3-2-6-13(15)12-7-4-10-16-14(12)8-5-11-18-16/h4-5,7-8,10-11,13,15,17H,2-3,6,9H2,1H3
InChIKeyQFBVUVIXYCZROE-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.48
Rot. Bonds2

About N-methyl-2-quinolin-5-ylcyclohexan-1-amine

N-methyl-2-quinolin-5-ylcyclohexan-1-amine (PubChem CID 81224622) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-methyl-2-quinolin-5-ylcyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-2-quinolin-5-ylcyclohexan-1-amine
PubChem CID81224622
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-methyl-2-quinolin-5-ylcyclohexan-1-amine
SMILESCNC1CCCCC1c1cccc2ncccc12
InChIInChI=1S/C16H20N2/c1-17-15-9-3-2-6-13(15)12-7-4-10-16-14(12)8-5-11-18-16/h4-5,7-8,10-11,13,15,17H,2-3,6,9H2,1H3
InChIKeyQFBVUVIXYCZROE-UHFFFAOYSA-N
XLogP3.48
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-quinolin-5-ylcyclohexan-1-amine?
The IUPAC name of N-methyl-2-quinolin-5-ylcyclohexan-1-amine (CID 81224622) is N-methyl-2-quinolin-5-ylcyclohexan-1-amine.
What is the SMILES notation for N-methyl-2-quinolin-5-ylcyclohexan-1-amine?
The canonical SMILES for N-methyl-2-quinolin-5-ylcyclohexan-1-amine is CNC1CCCCC1c1cccc2ncccc12.
What is the InChIKey of N-methyl-2-quinolin-5-ylcyclohexan-1-amine?
The InChIKey is QFBVUVIXYCZROE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-17-15-9-3-2-6-13(15)12-7-4-10-16-14(12)8-5-11-18-16/h4-5,7-8,10-11,13,15,17H,2-3,6,9H2,1H3.
What are the key properties of N-methyl-2-quinolin-5-ylcyclohexan-1-amine?
N-methyl-2-quinolin-5-ylcyclohexan-1-amine has a molecular weight of 240.35 g/mol, XLogP of 3.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-quinolin-5-ylcyclohexan-1-amine is sourced from PubChem (CID 81224622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).