[4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine

C16H21N3 — CID 63374155

IUPAC[4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine
SMILESCC1CCN(c2cc(CN)nc3ccccc23)CC1
InChIInChI=1S/C16H21N3/c1-12-6-8-19(9-7-12)16-10-13(11-17)18-15-5-3-2-4-14(15)16/h2-5,10,12H,6-9,11,17H2,1H3
InChIKeyWUFJDQSJTYHKFL-UHFFFAOYSA-N
MW255.37 g/mol
LogP2.93
Rot. Bonds2

About [4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine

[4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine (PubChem CID 63374155) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is [4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine.

Molecular Properties

Compound Name[4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine
PubChem CID63374155
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC Name[4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine
SMILESCC1CCN(c2cc(CN)nc3ccccc23)CC1
InChIInChI=1S/C16H21N3/c1-12-6-8-19(9-7-12)16-10-13(11-17)18-15-5-3-2-4-14(15)16/h2-5,10,12H,6-9,11,17H2,1H3
InChIKeyWUFJDQSJTYHKFL-UHFFFAOYSA-N
XLogP2.93
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine
CID 63374156
(4-thiomorpholin-4-ylquinolin-2-yl)methanamine
CID 63373907
[4-(3,4-dimethylpiperazin-1-yl)quinolin-2-yl]methanamine
CID 63620935
2-(4-methylphenyl)-4-(4-methylpiperidin-1-yl)quinoline
CID 135294181
1-[4-(4-ethylpiperidin-1-yl)quinolin-2-yl]-N-methylmethanamine
CID 63377701
[4-(3-ethyl-4-methylpiperazin-1-yl)quinolin-2-yl]methanamine
CID 63620945
2-(4-chlorophenyl)-4-(4-methylpiperidin-1-yl)quinoline
CID 70459272
1-[4-(azepan-1-yl)quinolin-2-yl]-N-methylmethanamine
CID 63374160
4-(2-ethylquinolin-4-yl)thiomorpholine
CID 133400472
2-ethyl-4-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)quinoline
CID 133402710
1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine
CID 63374122
[4-[3-(methoxymethyl)pyrrolidin-1-yl]quinolin-2-yl]methanol
CID 64598867

Frequently Asked Questions

What is the IUPAC name of [4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine?
The IUPAC name of [4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine (CID 63374155) is [4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine.
What is the SMILES notation for [4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine?
The canonical SMILES for [4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine is CC1CCN(c2cc(CN)nc3ccccc23)CC1.
What is the InChIKey of [4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine?
The InChIKey is WUFJDQSJTYHKFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-12-6-8-19(9-7-12)16-10-13(11-17)18-15-5-3-2-4-14(15)16/h2-5,10,12H,6-9,11,17H2,1H3.
What are the key properties of [4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine?
[4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine has a molecular weight of 255.37 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine is sourced from PubChem (CID 63374155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).