[1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine

C12H18ClN3 — CID 107160290

IUPAC[1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine
SMILESCC1(CN)CCN(c2ncccc2Cl)CC1
InChIInChI=1S/C12H18ClN3/c1-12(9-14)4-7-16(8-5-12)11-10(13)3-2-6-15-11/h2-3,6H,4-5,7-9,14H2,1H3
InChIKeyYXYDQNHTBJNFEM-UHFFFAOYSA-N
MW239.75 g/mol
LogP2.30
Rot. Bonds2

About [1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine

[1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine (PubChem CID 107160290) has the molecular formula C12H18ClN3 and a molecular weight of 239.75 g/mol. Its IUPAC name is [1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine.

Molecular Properties

Compound Name[1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine
PubChem CID107160290
Molecular FormulaC12H18ClN3
Molecular Weight239.75 g/mol
Exact Mass239.12
IUPAC Name[1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine
SMILESCC1(CN)CCN(c2ncccc2Cl)CC1
InChIInChI=1S/C12H18ClN3/c1-12(9-14)4-7-16(8-5-12)11-10(13)3-2-6-15-11/h2-3,6H,4-5,7-9,14H2,1H3
InChIKeyYXYDQNHTBJNFEM-UHFFFAOYSA-N
XLogP2.30
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.75
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-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

[1-(3-chloro-2-pyridinyl)-4-methoxypiperidin-4-yl]methanamine
CID 114284096
(4-methyl-1-quinazolin-4-ylpiperidin-4-yl)methanamine
CID 107160471
[3-chloro-2-(4-ethyl-4-methylpiperidin-1-yl)-4-pyridinyl]methanamine
CID 107055512
[4-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperidin-4-yl]methanamine
CID 107160723
2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-5-[(2-chloro-3-pyridinyl)sulfanyl]-1H-pyrimidin-6-one
CID 138690392
[1-[8-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-yl]-4-methylpiperidin-4-yl]methanamine
CID 164743866
3-bromo-2-(4,4-dimethylpiperidin-1-yl)pyridine
CID 55209852
1-(3-chloro-2-pyridinyl)piperidin-4-amine;hydrochloride
CID 69359259
[1-(3,5-difluoro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine
CID 107160431
[1-[(7-chloroquinolin-8-yl)methyl]-3-methylpyrrolidin-3-yl]methanamine
CID 120773381
[1-[5-(2-chlorophenyl)-1,3-thiazol-2-yl]-3-methylpyrrolidin-3-yl]methanamine
CID 139434665
3-chloro-2-(3-methylazetidin-1-yl)pyridine
CID 103094608

Frequently Asked Questions

What is the IUPAC name of [1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine?
The IUPAC name of [1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine (CID 107160290) is [1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine.
What is the SMILES notation for [1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine?
The canonical SMILES for [1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine is CC1(CN)CCN(c2ncccc2Cl)CC1.
What is the InChIKey of [1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine?
The InChIKey is YXYDQNHTBJNFEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClN3/c1-12(9-14)4-7-16(8-5-12)11-10(13)3-2-6-15-11/h2-3,6H,4-5,7-9,14H2,1H3.
What are the key properties of [1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine?
[1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine has a molecular weight of 239.75 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine is sourced from PubChem (CID 107160290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).