2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine

C18H24N2 — CID 104997388

IUPAC2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
SMILESCC1(C)C(C(N)Cc2ccnc3ccccc23)C1(C)C
InChIInChI=1S/C18H24N2/c1-17(2)16(18(17,3)4)14(19)11-12-9-10-20-15-8-6-5-7-13(12)15/h5-10,14,16H,11,19H2,1-4H3
InChIKeyKBTOSQSYBNVBIT-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.79
Rot. Bonds3

About 2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine

2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine (PubChem CID 104997388) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine.

Molecular Properties

Compound Name2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
PubChem CID104997388
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
SMILESCC1(C)C(C(N)Cc2ccnc3ccccc23)C1(C)C
InChIInChI=1S/C18H24N2/c1-17(2)16(18(17,3)4)14(19)11-12-9-10-20-15-8-6-5-7-13(12)15/h5-10,14,16H,11,19H2,1-4H3
InChIKeyKBTOSQSYBNVBIT-UHFFFAOYSA-N
XLogP3.79
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-quinolin-4-yl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
CID 104997435
4-(2-ethylbutyl)quinoline
CID 143495355
2,3-dimethyl-4-quinolin-4-ylbutan-1-amine
CID 81015009
3-methyl-4-methylsulfanyl-1-quinolin-4-ylbutan-2-amine
CID 114221993
4-(2-chlorobutyl)quinoline
CID 63203241
1-cyclobutyl-3-quinolin-4-ylpropan-2-amine
CID 103168915
[1-(2,2-dimethylcyclopentyl)-2-quinolin-4-ylethyl]hydrazine
CID 107194203
1-(1-ethoxycyclopentyl)-2-quinolin-4-ylethanamine
CID 116761616
2,2-dimethyl-N-(quinolin-4-ylmethyl)cyclopropan-1-amine
CID 55258797
1-(2-iodophenyl)-2-quinolin-4-ylethanamine
CID 104997408
3-quinolin-4-yl-2-(quinolin-4-ylmethyl)propanal
CID 19824915
methyl 3-amino-2-methyl-4-quinolin-4-ylbutanoate
CID 171618052

Frequently Asked Questions

What is the IUPAC name of 2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
The IUPAC name of 2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine (CID 104997388) is 2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine.
What is the SMILES notation for 2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
The canonical SMILES for 2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine is CC1(C)C(C(N)Cc2ccnc3ccccc23)C1(C)C.
What is the InChIKey of 2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
The InChIKey is KBTOSQSYBNVBIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-17(2)16(18(17,3)4)14(19)11-12-9-10-20-15-8-6-5-7-13(12)15/h5-10,14,16H,11,19H2,1-4H3.
What are the key properties of 2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine has a molecular weight of 268.40 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine is sourced from PubChem (CID 104997388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).