(1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine

C18H28N2O — CID 116763627

IUPAC(1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine
SMILESCCOC1(C(N)C2CCCc3cccnc32)CCCCC1
InChIInChI=1S/C18H28N2O/c1-2-21-18(11-4-3-5-12-18)17(19)15-10-6-8-14-9-7-13-20-16(14)15/h7,9,13,15,17H,2-6,8,10-12,19H2,1H3
InChIKeyUUTBQEUUKPMCQK-UHFFFAOYSA-N
MW288.43 g/mol
LogP3.57
Rot. Bonds4

About (1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine

(1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine (PubChem CID 116763627) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is (1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine.

Molecular Properties

Compound Name(1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine
PubChem CID116763627
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC Name(1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine
SMILESCCOC1(C(N)C2CCCc3cccnc32)CCCCC1
InChIInChI=1S/C18H28N2O/c1-2-21-18(11-4-3-5-12-18)17(19)15-10-6-8-14-9-7-13-20-16(14)15/h7,9,13,15,17H,2-6,8,10-12,19H2,1H3
InChIKeyUUTBQEUUKPMCQK-UHFFFAOYSA-N
XLogP3.57
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine with MolForge

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Related Compounds

6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methylcyclohexyl)methanamine
CID 106830346
2-ethoxy-2-ethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-amine
CID 116759628
1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-amine
CID 79748417
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-ethoxy-3-methylcyclohexyl)methanol
CID 116755172
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine
CID 116766235
5,6,7,8-tetrahydroquinolin-8-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 105007390
(8R)-8-propan-2-yl-5,6,7,8-tetrahydroquinoline
CID 58752937
1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine
CID 105007437
2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 81021345
(3-ethoxyphenyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine
CID 79731976
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-ethoxyethanamine
CID 79747927
8-pentan-2-yl-5,6,7,8-tetrahydroquinoline
CID 67125718

Frequently Asked Questions

What is the IUPAC name of (1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine?
The IUPAC name of (1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine (CID 116763627) is (1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine.
What is the SMILES notation for (1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine?
The canonical SMILES for (1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine is CCOC1(C(N)C2CCCc3cccnc32)CCCCC1.
What is the InChIKey of (1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine?
The InChIKey is UUTBQEUUKPMCQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-2-21-18(11-4-3-5-12-18)17(19)15-10-6-8-14-9-7-13-20-16(14)15/h7,9,13,15,17H,2-6,8,10-12,19H2,1H3.
What are the key properties of (1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine?
(1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine has a molecular weight of 288.43 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine is sourced from PubChem (CID 116763627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).