N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine

C18H24N2 — CID 81222497

IUPACN-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine
SMILESCNCC1CCC(C)CC1c1ccc2ncccc2c1
InChIInChI=1S/C18H24N2/c1-13-5-6-16(12-19-2)17(10-13)14-7-8-18-15(11-14)4-3-9-20-18/h3-4,7-9,11,13,16-17,19H,5-6,10,12H2,1-2H3
InChIKeySNRPUKRLWIHXBN-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.97
Rot. Bonds3

About N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine

N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine (PubChem CID 81222497) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine
PubChem CID81222497
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC NameN-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine
SMILESCNCC1CCC(C)CC1c1ccc2ncccc2c1
InChIInChI=1S/C18H24N2/c1-13-5-6-16(12-19-2)17(10-13)14-7-8-18-15(11-14)4-3-9-20-18/h3-4,7-9,11,13,16-17,19H,5-6,10,12H2,1-2H3
InChIKeySNRPUKRLWIHXBN-UHFFFAOYSA-N
XLogP3.97
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine?
The IUPAC name of N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine (CID 81222497) is N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine.
What is the SMILES notation for N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine?
The canonical SMILES for N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine is CNCC1CCC(C)CC1c1ccc2ncccc2c1.
What is the InChIKey of N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine?
The InChIKey is SNRPUKRLWIHXBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-13-5-6-16(12-19-2)17(10-13)14-7-8-18-15(11-14)4-3-9-20-18/h3-4,7-9,11,13,16-17,19H,5-6,10,12H2,1-2H3.
What are the key properties of N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine?
N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine has a molecular weight of 268.40 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methyl-2-quinolin-6-ylcyclohexyl)methanamine is sourced from PubChem (CID 81222497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).