1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine

C16H20N2 — CID 114229416

IUPAC1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine
SMILESCNCC1C(c2ccnc3ccccc23)C1(C)C
InChIInChI=1S/C16H20N2/c1-16(2)13(10-17-3)15(16)12-8-9-18-14-7-5-4-6-11(12)14/h4-9,13,15,17H,10H2,1-3H3
InChIKeyWPTIZEXLAMBYDT-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.19
Rot. Bonds3

About 1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine

1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine (PubChem CID 114229416) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine
PubChem CID114229416
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine
SMILESCNCC1C(c2ccnc3ccccc23)C1(C)C
InChIInChI=1S/C16H20N2/c1-16(2)13(10-17-3)15(16)12-8-9-18-14-7-5-4-6-11(12)14/h4-9,13,15,17H,10H2,1-3H3
InChIKeyWPTIZEXLAMBYDT-UHFFFAOYSA-N
XLogP3.19
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(1R,3R)-2,2-dimethyl-3-quinolin-4-ylcyclopropyl]methanamine
CID 178195092
(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)methanamine
CID 114229374
4-(azepan-2-yl)quinoline
CID 81147055
4-cyclopentylquinoline
CID 57273226
N-methyl-N'-quinolin-4-ylethane-1,2-diamine
CID 62658935
N-methyl-1-(1-quinolin-4-ylpyrrolidin-2-yl)methanamine
CID 62585638
2,2-dimethyl-N-(quinolin-4-ylmethyl)cyclopropan-1-amine
CID 55258797
4-quinolin-4-ylazetidin-2-one
CID 55255536
4-chloroquinoline;ethane
CID 91461667
4-(2-ethylpyrrolidin-3-yl)quinoline
CID 63868928
1-[3-(3-ethoxyphenyl)-2,2-dimethylcyclopropyl]-N-methylmethanamine
CID 114229412
2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
CID 104997388

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine?
The IUPAC name of 1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine (CID 114229416) is 1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine?
The canonical SMILES for 1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine is CNCC1C(c2ccnc3ccccc23)C1(C)C.
What is the InChIKey of 1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine?
The InChIKey is WPTIZEXLAMBYDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-16(2)13(10-17-3)15(16)12-8-9-18-14-7-5-4-6-11(12)14/h4-9,13,15,17H,10H2,1-3H3.
What are the key properties of 1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine?
1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine has a molecular weight of 240.35 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethyl-3-quinolin-4-ylcyclopropyl)-N-methylmethanamine is sourced from PubChem (CID 114229416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).