6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine

C14H22ClN3 — CID 114049259

IUPAC6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine
SMILESCc1cc(NC2CC(C)N(C)CC2C)cnc1Cl
InChIInChI=1S/C14H22ClN3/c1-9-5-12(7-16-14(9)15)17-13-6-11(3)18(4)8-10(13)2/h5,7,10-11,13,17H,6,8H2,1-4H3
InChIKeyXKFVCJKCKDJCIB-UHFFFAOYSA-N
MW267.80 g/mol
LogP3.18
Rot. Bonds2

About 6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine

6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine (PubChem CID 114049259) has the molecular formula C14H22ClN3 and a molecular weight of 267.80 g/mol. Its IUPAC name is 6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine
PubChem CID114049259
Molecular FormulaC14H22ClN3
Molecular Weight267.80 g/mol
Exact Mass267.15
IUPAC Name6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine
SMILESCc1cc(NC2CC(C)N(C)CC2C)cnc1Cl
InChIInChI=1S/C14H22ClN3/c1-9-5-12(7-16-14(9)15)17-13-6-11(3)18(4)8-10(13)2/h5,7,10-11,13,17H,6,8H2,1-4H3
InChIKeyXKFVCJKCKDJCIB-UHFFFAOYSA-N
XLogP3.18
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.80
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine
CID 113354139
N-(4-chlorophenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665402
5-bromo-6-morpholin-4-yl-N-[(2R,4S,5R)-1,2,5-trimethylpiperidin-4-yl]pyridin-3-amine
CID 124888694
N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665303
N-(4-bromo-2,6-dimethylphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 54863711
N-(4-chloro-3-methoxyphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 107270537
N-(3-chloro-4-methoxyphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665336
6-chloro-N-cyclooctyl-5-methylpyridin-3-amine
CID 114049267
N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665344
N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665401
2,5-dimethyl-4-[(1,2,5-trimethylpiperidin-4-yl)amino]phenol
CID 106953917
2-chloro-N-methyl-5-[(1,2,5-trimethylpiperidin-4-yl)amino]benzamide
CID 60936196

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine?
The IUPAC name of 6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine (CID 114049259) is 6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine.
What is the SMILES notation for 6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine?
The canonical SMILES for 6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine is Cc1cc(NC2CC(C)N(C)CC2C)cnc1Cl.
What is the InChIKey of 6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine?
The InChIKey is XKFVCJKCKDJCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22ClN3/c1-9-5-12(7-16-14(9)15)17-13-6-11(3)18(4)8-10(13)2/h5,7,10-11,13,17H,6,8H2,1-4H3.
What are the key properties of 6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine?
6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine has a molecular weight of 267.80 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine is sourced from PubChem (CID 114049259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).