(2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine

C23H26N2O — CID 11057125

IUPAC(2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine
SMILESC=CCC1Oc2cccc(CN)c2-c2ccc3c(c21)C(C)=CC(C)(C)N3
InChIInChI=1S/C23H26N2O/c1-5-7-18-22-16(21-15(13-24)8-6-9-19(21)26-18)10-11-17-20(22)14(2)12-23(3,4)25-17/h5-6,8-12,18,25H,1,7,13,24H2,2-4H3
InChIKeyNBXZWVNWURAUNV-UHFFFAOYSA-N
MW346.47 g/mol
LogP5.43
Rot. Bonds3

About (2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine

(2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine (PubChem CID 11057125) has the molecular formula C23H26N2O and a molecular weight of 346.47 g/mol. Its IUPAC name is (2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine.

Molecular Properties

Compound Name(2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine
PubChem CID11057125
Molecular FormulaC23H26N2O
Molecular Weight346.47 g/mol
Exact Mass346.20
IUPAC Name(2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine
SMILESC=CCC1Oc2cccc(CN)c2-c2ccc3c(c21)C(C)=CC(C)(C)N3
InChIInChI=1S/C23H26N2O/c1-5-7-18-22-16(21-15(13-24)8-6-9-19(21)26-18)10-11-17-20(22)14(2)12-23(3,4)25-17/h5-6,8-12,18,25H,1,7,13,24H2,2-4H3
InChIKeyNBXZWVNWURAUNV-UHFFFAOYSA-N
XLogP5.43
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.47
LogP ≤ 55.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine?
The IUPAC name of (2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine (CID 11057125) is (2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine.
What is the SMILES notation for (2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine?
The canonical SMILES for (2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine is C=CCC1Oc2cccc(CN)c2-c2ccc3c(c21)C(C)=CC(C)(C)N3.
What is the InChIKey of (2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine?
The InChIKey is NBXZWVNWURAUNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O/c1-5-7-18-22-16(21-15(13-24)8-6-9-19(21)26-18)10-11-17-20(22)14(2)12-23(3,4)25-17/h5-6,8-12,18,25H,1,7,13,24H2,2-4H3.
What are the key properties of (2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine?
(2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine has a molecular weight of 346.47 g/mol, XLogP of 5.43, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2,4-trimethyl-5-prop-2-enyl-1,5-dihydrochromeno[3,4-f]quinolin-10-yl)methanamine is sourced from PubChem (CID 11057125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).