[4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine

C17H20N2 — CID 39226329

IUPAC[4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine
SMILESCN1CCCc2cc(-c3ccc(CN)cc3)ccc21
InChIInChI=1S/C17H20N2/c1-19-10-2-3-16-11-15(8-9-17(16)19)14-6-4-13(12-18)5-7-14/h4-9,11H,2-3,10,12,18H2,1H3
InChIKeySLMITXZWRSGCOD-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.19
Rot. Bonds2

About [4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine

[4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine (PubChem CID 39226329) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is [4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine.

Molecular Properties

Compound Name[4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine
PubChem CID39226329
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name[4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine
SMILESCN1CCCc2cc(-c3ccc(CN)cc3)ccc21
InChIInChI=1S/C17H20N2/c1-19-10-2-3-16-11-15(8-9-17(16)19)14-6-4-13(12-18)5-7-14/h4-9,11H,2-3,10,12,18H2,1H3
InChIKeySLMITXZWRSGCOD-UHFFFAOYSA-N
XLogP3.19
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]propan-2-one
CID 82540729
2-[4-(1-methyl-2,3-dihydroindol-5-yl)phenyl]ethanamine
CID 39226206
1-methyl-6-pyrimidin-5-yl-3,4-dihydro-2H-quinoline
CID 121385714
2-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]guanidine
CID 110916631
N'-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]butane-1,4-diamine
CID 62094966
N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]prop-2-en-1-amine
CID 62072231
3-[5-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)furan-2-yl]butan-1-amine
CID 82542289
(E)-3-[4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]pent-2-enoic acid
CID 110447148
3-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-2-propan-2-ylbutan-1-amine
CID 102904608
3-(1-methyl-2,3-dihydroindol-5-yl)propan-1-amine
CID 62095510
hexane;1-methyl-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline
CID 145091188
1-[[5-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-3-pyridinyl]methyl]piperidin-2-one
CID 123139132

Frequently Asked Questions

What is the IUPAC name of [4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine?
The IUPAC name of [4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine (CID 39226329) is [4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine.
What is the SMILES notation for [4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine?
The canonical SMILES for [4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine is CN1CCCc2cc(-c3ccc(CN)cc3)ccc21.
What is the InChIKey of [4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine?
The InChIKey is SLMITXZWRSGCOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-19-10-2-3-16-11-15(8-9-17(16)19)14-6-4-13(12-18)5-7-14/h4-9,11H,2-3,10,12,18H2,1H3.
What are the key properties of [4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine?
[4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine has a molecular weight of 252.36 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methanamine is sourced from PubChem (CID 39226329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).