[1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine

C16H21N3 — CID 43209671

IUPAC[1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine
SMILESNCC1CCCCN1Cc1ccc2ncccc2c1
InChIInChI=1S/C16H21N3/c17-11-15-5-1-2-9-19(15)12-13-6-7-16-14(10-13)4-3-8-18-16/h3-4,6-8,10,15H,1-2,5,9,11-12,17H2
InChIKeyUBJIPFZWCTVCQI-UHFFFAOYSA-N
MW255.37 g/mol
LogP2.55
Rot. Bonds3

About [1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine

[1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine (PubChem CID 43209671) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is [1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine
PubChem CID43209671
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC Name[1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine
SMILESNCC1CCCCN1Cc1ccc2ncccc2c1
InChIInChI=1S/C16H21N3/c17-11-15-5-1-2-9-19(15)12-13-6-7-16-14(10-13)4-3-8-18-16/h3-4,6-8,10,15H,1-2,5,9,11-12,17H2
InChIKeyUBJIPFZWCTVCQI-UHFFFAOYSA-N
XLogP2.55
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[[2-(bromomethyl)piperidin-1-yl]methyl]quinoline
CID 80673665
2-[1-(quinolin-6-ylmethyl)piperidin-2-yl]acetic acid
CID 61010277
N-[[1-(quinolin-6-ylmethyl)pyrrolidin-2-yl]methyl]propan-2-amine
CID 62581089
N'-hydroxy-1-(quinolin-6-ylmethyl)piperidine-2-carboximidamide
CID 77036050
[4-methyl-1-(quinolin-6-ylmethyl)piperazin-2-yl]methanamine
CID 80504294
3-[1-(quinolin-6-ylmethyl)pyrrolidin-2-yl]propan-1-ol
CID 62469231
N'-hydroxy-1-(quinolin-6-ylmethyl)pyrrolidine-2-carboximidamide
CID 77036107
[1-[(2-methylquinolin-6-yl)methyl]pyrrolidin-2-yl]methanamine;hydrochloride
CID 120841918
[1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine
CID 62062726
6-[[(2S)-2-pyrimidin-4-ylpyrrolidin-1-yl]methyl]quinoline
CID 124986639
[1-[(4-chlorophenyl)methyl]piperidin-2-yl]methanamine
CID 23074040
[1-[(3-bromophenyl)methyl]piperidin-2-yl]methanamine
CID 43187044

Frequently Asked Questions

What is the IUPAC name of [1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine?
The IUPAC name of [1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine (CID 43209671) is [1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine.
What is the SMILES notation for [1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine?
The canonical SMILES for [1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine is NCC1CCCCN1Cc1ccc2ncccc2c1.
What is the InChIKey of [1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine?
The InChIKey is UBJIPFZWCTVCQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c17-11-15-5-1-2-9-19(15)12-13-6-7-16-14(10-13)4-3-8-18-16/h3-4,6-8,10,15H,1-2,5,9,11-12,17H2.
What are the key properties of [1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine?
[1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine has a molecular weight of 255.37 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine is sourced from PubChem (CID 43209671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).