1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine

C16H26N2 — CID 84632624

IUPAC1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1CCc2cc(C(C)(C)C)ccc2N1
InChIInChI=1S/C16H26N2/c1-16(2,3)13-7-9-15-12(10-13)6-8-14(17-15)11-18(4)5/h7,9-10,14,17H,6,8,11H2,1-5H3
InChIKeyLVPDSXFCFYYJJO-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.27
Rot. Bonds2

About 1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine

1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine (PubChem CID 84632624) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine
PubChem CID84632624
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1CCc2cc(C(C)(C)C)ccc2N1
InChIInChI=1S/C16H26N2/c1-16(2,3)13-7-9-15-12(10-13)6-8-14(17-15)11-18(4)5/h7,9-10,14,17H,6,8,11H2,1-5H3
InChIKeyLVPDSXFCFYYJJO-UHFFFAOYSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine with MolForge

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Related Compounds

(2S)-2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
CID 142935353
N-[[6-(trifluoromethyl)-1,2,3,4-tetrahydroquinolin-2-yl]methyl]propan-1-amine
CID 22735274
1-(5-methoxy-2,3-dihydro-1H-indol-2-yl)-N,N-dimethylmethanamine
CID 84739877
3-tert-butylbicyclo[4.2.0]octa-1(6),2,4-triene
CID 15438926
(2-ethyl-1,2,3,4-tetrahydroquinolin-6-yl)chloranium
CID 163552532
5-tert-butyl-2-(5-methylthiophen-2-yl)-2,3-dihydro-1H-indole
CID 3533032
(2S)-2-ethyl-7-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
CID 67764160
(2S)-2-ethyl-6-methoxy-1,2,3,4-tetrahydroquinoline
CID 131025344
5-tert-butyl-2,3-dihydro-1H-indene
CID 15271758
2-(methylaminomethyl)-1,2,3,4-tetrahydroquinolin-6-ol
CID 105446256
[(2R)-6-methylsulfanyl-1,2,3,4-tetrahydroquinolin-2-yl]methanol
CID 130626606
2-(4-tert-butylphenyl)-6-propan-2-yl-1,2,3,4-tetrahydroquinoline
CID 10807358

Frequently Asked Questions

What is the IUPAC name of 1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine (CID 84632624) is 1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine is CN(C)CC1CCc2cc(C(C)(C)C)ccc2N1.
What is the InChIKey of 1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine?
The InChIKey is LVPDSXFCFYYJJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-16(2,3)13-7-9-15-12(10-13)6-8-14(17-15)11-18(4)5/h7,9-10,14,17H,6,8,11H2,1-5H3.
What are the key properties of 1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine?
1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine has a molecular weight of 246.40 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-tert-butyl-1,2,3,4-tetrahydroquinolin-2-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 84632624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).