1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine

C16H20N2 — CID 81221236

IUPAC1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine
SMILESCNC(CCc1ccc2ncccc2c1)C1CC1
InChIInChI=1S/C16H20N2/c1-17-15(13-6-7-13)8-4-12-5-9-16-14(11-12)3-2-10-18-16/h2-3,5,9-11,13,15,17H,4,6-8H2,1H3
InChIKeyNSESHMWIMOCIGP-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.17
Rot. Bonds5

About 1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine

1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine (PubChem CID 81221236) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine
PubChem CID81221236
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine
SMILESCNC(CCc1ccc2ncccc2c1)C1CC1
InChIInChI=1S/C16H20N2/c1-17-15(13-6-7-13)8-4-12-5-9-16-14(11-12)3-2-10-18-16/h2-3,5,9-11,13,15,17H,4,6-8H2,1H3
InChIKeyNSESHMWIMOCIGP-UHFFFAOYSA-N
XLogP3.17
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-quinolin-6-ylpentan-3-amine
CID 81221541
4-methyl-1-quinolin-6-ylpentan-3-amine
CID 81224108
(1S)-1-cycloheptyl-N-(quinolin-6-ylmethyl)ethanamine
CID 81388844
3-(3-chlorophenyl)-1-cyclopropyl-N-methylpropan-1-amine
CID 63355001
6-(2-chloroethyl)quinoline
CID 53404433
6-(2-bromoethyl)quinoline
CID 68811984
N-methyl-1-(4-methylcyclohexyl)-1-quinolin-6-ylmethanamine
CID 64776674
2-methyl-N-(quinolin-6-ylmethyl)cyclohexan-1-amine
CID 43183350
3-cyclopentyl-N-methyl-1-quinolin-6-ylpropan-1-amine
CID 105021015
2-methyl-N-(2-quinolin-6-ylethyl)propan-2-amine
CID 62549001
6-[2-(oxiran-2-yl)ethyl]quinoline
CID 130239361
1-(oxan-4-yl)-N-(quinolin-6-ylmethyl)ethanamine
CID 103769027

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine?
The IUPAC name of 1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine (CID 81221236) is 1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine.
What is the SMILES notation for 1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine?
The canonical SMILES for 1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine is CNC(CCc1ccc2ncccc2c1)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine?
The InChIKey is NSESHMWIMOCIGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-17-15(13-6-7-13)8-4-12-5-9-16-14(11-12)3-2-10-18-16/h2-3,5,9-11,13,15,17H,4,6-8H2,1H3.
What are the key properties of 1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine?
1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine has a molecular weight of 240.35 g/mol, XLogP of 3.17, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-methyl-3-quinolin-6-ylpropan-1-amine is sourced from PubChem (CID 81221236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).