[(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine

C17H28N2O — CID 125046682

IUPAC[(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine
SMILESCCCN1c2cc(OC)c(CN)cc2[C@H](C)CC1(C)C
InChIInChI=1S/C17H28N2O/c1-6-7-19-15-9-16(20-5)13(11-18)8-14(15)12(2)10-17(19,3)4/h8-9,12H,6-7,10-11,18H2,1-5H3/t12-/m1/s1
InChIKeyLFUTWNNCTLFKBB-GFCCVEGCSA-N
MW276.42 g/mol
LogP3.66
Rot. Bonds4

About [(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine

[(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine (PubChem CID 125046682) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is [(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine.

Molecular Properties

Compound Name[(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine
PubChem CID125046682
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name[(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine
SMILESCCCN1c2cc(OC)c(CN)cc2[C@H](C)CC1(C)C
InChIInChI=1S/C17H28N2O/c1-6-7-19-15-9-16(20-5)13(11-18)8-14(15)12(2)10-17(19,3)4/h8-9,12H,6-7,10-11,18H2,1-5H3/t12-/m1/s1
InChIKeyLFUTWNNCTLFKBB-GFCCVEGCSA-N
XLogP3.66
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine with MolForge

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Launch Full Analysis

Related Compounds

(1-ethyl-7-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-6-yl)methanamine
CID 133203005
N-[[(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methyl]ethanamine
CID 125047021
(7-methoxy-2,2,4-trimethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl)methanamine
CID 133203007
1-(1-butyl-7-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-6-yl)-N-methylmethanamine
CID 133203032
(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinoline-6-carbonitrile
CID 125046694
N-[[(4R)-1-butyl-7-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-6-yl]methyl]ethanamine
CID 125047278
(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanamine
CID 133198872
1-(7-methoxy-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)-N-methylmethanamine
CID 133203028
(5E)-5-[(7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl)methylidene]-3-methyl-2-methylimino-1,3-thiazolidin-4-one
CID 50863810
(4S)-1-ethyl-7-methoxy-2,2,4-trimethyl-3,4-dihydroquinoline-6-carbaldehyde
CID 99130482
N-(2,4-difluorophenyl)-1-(7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl)methanimine
CID 50863685
N-(2-methoxyphenyl)-1-(2,2,4,7-tetramethyl-1-propyl-3,4-dihydroquinolin-6-yl)methanimine
CID 50862689

Frequently Asked Questions

What is the IUPAC name of [(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine?
The IUPAC name of [(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine (CID 125046682) is [(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine.
What is the SMILES notation for [(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine?
The canonical SMILES for [(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine is CCCN1c2cc(OC)c(CN)cc2[C@H](C)CC1(C)C.
What is the InChIKey of [(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine?
The InChIKey is LFUTWNNCTLFKBB-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H28N2O/c1-6-7-19-15-9-16(20-5)13(11-18)8-14(15)12(2)10-17(19,3)4/h8-9,12H,6-7,10-11,18H2,1-5H3/t12-/m1/s1.
What are the key properties of [(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine?
[(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine has a molecular weight of 276.42 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-7-methoxy-2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl]methanamine is sourced from PubChem (CID 125046682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).