3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine

C18H25N3 — CID 82107815

IUPAC3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine
SMILESCC1CCCCN1CC(CN)c1ccc2ncccc2c1
InChIInChI=1S/C18H25N3/c1-14-5-2-3-10-21(14)13-17(12-19)15-7-8-18-16(11-15)6-4-9-20-18/h4,6-9,11,14,17H,2-3,5,10,12-13,19H2,1H3
InChIKeyUATBXTFPDOCEGM-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.15
Rot. Bonds4

About 3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine

3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine (PubChem CID 82107815) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine.

Molecular Properties

Compound Name3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine
PubChem CID82107815
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine
SMILESCC1CCCCN1CC(CN)c1ccc2ncccc2c1
InChIInChI=1S/C18H25N3/c1-14-5-2-3-10-21(14)13-17(12-19)15-7-8-18-16(11-15)6-4-9-20-18/h4,6-9,11,14,17H,2-3,5,10,12-13,19H2,1H3
InChIKeyUATBXTFPDOCEGM-UHFFFAOYSA-N
XLogP3.15
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-quinolin-6-ylpropan-1-amine
CID 79002101
[1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine
CID 43209671
6-(1-ethylpiperidin-2-yl)quinoline
CID 102544431
2-(2-methyl-1,4-oxazepan-4-yl)-2-quinolin-6-ylethanamine
CID 63968717
2-methyl-2-pyrrolidin-1-yl-1-quinolin-6-ylpropan-1-ol
CID 81219930
2-(4-methyl-1,4-diazepan-1-yl)-2-quinolin-6-ylethanamine
CID 63968294
[cyclopentyl(quinolin-6-yl)methyl]hydrazine
CID 105204471
N'-hydroxy-1-(quinolin-6-ylmethyl)piperidine-2-carboximidamide
CID 77036050
cyclopropyl(quinolin-6-yl)methanamine
CID 55273103
N-methyl-N-phenyl-1-quinolin-6-ylethane-1,2-diamine
CID 63967659
2-cycloheptyl-1-quinolin-6-ylethanol
CID 115826801
N-propyl-1-quinolin-6-ylethane-1,2-diamine
CID 63967677

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine?
The IUPAC name of 3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine (CID 82107815) is 3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine.
What is the SMILES notation for 3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine?
The canonical SMILES for 3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine is CC1CCCCN1CC(CN)c1ccc2ncccc2c1.
What is the InChIKey of 3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine?
The InChIKey is UATBXTFPDOCEGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-14-5-2-3-10-21(14)13-17(12-19)15-7-8-18-16(11-15)6-4-9-20-18/h4,6-9,11,14,17H,2-3,5,10,12-13,19H2,1H3.
What are the key properties of 3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine?
3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpiperidin-1-yl)-2-quinolin-6-ylpropan-1-amine is sourced from PubChem (CID 82107815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).