N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine

C15H22N2 — CID 105488657

IUPACN-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine
SMILESc1ccc2c(c1)NCCC2NC1CCCCC1
InChIInChI=1S/C15H22N2/c1-2-6-12(7-3-1)17-15-10-11-16-14-9-5-4-8-13(14)15/h4-5,8-9,12,15-17H,1-3,6-7,10-11H2
InChIKeyMKXGTEFZLNXLHP-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.47
Rot. Bonds2

About N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine

N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine (PubChem CID 105488657) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine
PubChem CID105488657
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC NameN-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine
SMILESc1ccc2c(c1)NCCC2NC1CCCCC1
InChIInChI=1S/C15H22N2/c1-2-6-12(7-3-1)17-15-10-11-16-14-9-5-4-8-13(14)15/h4-5,8-9,12,15-17H,1-3,6-7,10-11H2
InChIKeyMKXGTEFZLNXLHP-UHFFFAOYSA-N
XLogP3.47
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine?
The IUPAC name of N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine (CID 105488657) is N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine.
What is the SMILES notation for N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine?
The canonical SMILES for N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine is c1ccc2c(c1)NCCC2NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine?
The InChIKey is MKXGTEFZLNXLHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-2-6-12(7-3-1)17-15-10-11-16-14-9-5-4-8-13(14)15/h4-5,8-9,12,15-17H,1-3,6-7,10-11H2.
What are the key properties of N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine?
N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine has a molecular weight of 230.35 g/mol, XLogP of 3.47, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1,2,3,4-tetrahydroquinolin-4-amine is sourced from PubChem (CID 105488657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).