4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine

C16H26N2O — CID 135234400

IUPAC4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine
SMILESCC1C=CC(C)(N2CCOCC2)C2=C1CCCN2C
InChIInChI=1S/C16H26N2O/c1-13-6-7-16(2,18-9-11-19-12-10-18)15-14(13)5-4-8-17(15)3/h6-7,13H,4-5,8-12H2,1-3H3
InChIKeyRFYMARNLSPRPNM-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.26
Rot. Bonds1

About 4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine

4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine (PubChem CID 135234400) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine.

Molecular Properties

Compound Name4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine
PubChem CID135234400
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine
SMILESCC1C=CC(C)(N2CCOCC2)C2=C1CCCN2C
InChIInChI=1S/C16H26N2O/c1-13-6-7-16(2,18-9-11-19-12-10-18)15-14(13)5-4-8-17(15)3/h6-7,13H,4-5,8-12H2,1-3H3
InChIKeyRFYMARNLSPRPNM-UHFFFAOYSA-N
XLogP2.26
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine?
The IUPAC name of 4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine (CID 135234400) is 4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine.
What is the SMILES notation for 4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine?
The canonical SMILES for 4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine is CC1C=CC(C)(N2CCOCC2)C2=C1CCCN2C.
What is the InChIKey of 4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine?
The InChIKey is RFYMARNLSPRPNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-13-6-7-16(2,18-9-11-19-12-10-18)15-14(13)5-4-8-17(15)3/h6-7,13H,4-5,8-12H2,1-3H3.
What are the key properties of 4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine?
4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine has a molecular weight of 262.40 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,5,8-trimethyl-2,3,4,5-tetrahydroquinolin-8-yl)morpholine is sourced from PubChem (CID 135234400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).