[2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine

C12H21N3 — CID 86340846

IUPAC[2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine
SMILESCC1CCN(C2C=CC(CN)=CN2)CC1
InChIInChI=1S/C12H21N3/c1-10-4-6-15(7-5-10)12-3-2-11(8-13)9-14-12/h2-3,9-10,12,14H,4-8,13H2,1H3
InChIKeyJCSJQNNTFIYNDN-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.05
Rot. Bonds2

About [2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine

[2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine (PubChem CID 86340846) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is [2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine.

Molecular Properties

Compound Name[2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine
PubChem CID86340846
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name[2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine
SMILESCC1CCN(C2C=CC(CN)=CN2)CC1
InChIInChI=1S/C12H21N3/c1-10-4-6-15(7-5-10)12-3-2-11(8-13)9-14-12/h2-3,9-10,12,14H,4-8,13H2,1H3
InChIKeyJCSJQNNTFIYNDN-UHFFFAOYSA-N
XLogP1.05
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Octahydro 4,4'-bipyridyl
CID 4867470
6-(4-Methylpiperidin-1-yl)-2-(trifluoromethyl)-1,2-dihydropyridine
CID 173540148
2-Piperidino-methylazepine
CID 129706955
1-methyl-2-(4-methylpiperidin-1-yl)-5-(trifluoromethyl)-2H-pyridine
CID 162576321
1,2,3,4,8,8a-Hexahydro-1,8-naphthyridine
CID 22714282
2-(1-Propylpiperazin-2-yl)-1,3,3a,4-tetrahydroisoindole
CID 67612375
(9R)-9-methyl-2-piperidin-1-yl-2,5,6,7,8,9-hexahydro-1H-pyrido[2,3-d]azepine
CID 69025863
2-(1-Ethylpiperazin-2-yl)-1,3,3a,4-tetrahydroisoindole
CID 70172963
1',7-dimethylspiro[2,7a-dihydro-1H-pyrrolo[2,3-b]pyridine-3,4'-piperidine]
CID 91070647
4-ethyl-2,3,4,9-tetrahydro-1H-pyrido[2,3-b]azepine
CID 118170636
5-methyl-N-(2-piperidin-1-ylethyl)-1,2-dihydropyridin-2-amine
CID 126490058
4-Ethyl-6-piperidin-1-yl-1,2-dihydropyridine
CID 129215824

Frequently Asked Questions

What is the IUPAC name of [2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine?
The IUPAC name of [2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine (CID 86340846) is [2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine.
What is the SMILES notation for [2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine?
The canonical SMILES for [2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine is CC1CCN(C2C=CC(CN)=CN2)CC1.
What is the InChIKey of [2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine?
The InChIKey is JCSJQNNTFIYNDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-10-4-6-15(7-5-10)12-3-2-11(8-13)9-14-12/h2-3,9-10,12,14H,4-8,13H2,1H3.
What are the key properties of [2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine?
[2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine has a molecular weight of 207.32 g/mol, XLogP of 1.05, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methylpiperidin-1-yl)-1,2-dihydropyridin-5-yl]methanamine is sourced from PubChem (CID 86340846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).