1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine

C10H15ClN2 — CID 55271130

IUPAC1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine
SMILESCc1cc(C(N)C(C)C)cc(Cl)n1
InChIInChI=1S/C10H15ClN2/c1-6(2)10(12)8-4-7(3)13-9(11)5-8/h4-6,10H,12H2,1-3H3
InChIKeyCADZGLMLVFEKGB-UHFFFAOYSA-N
MW198.70 g/mol
LogP2.70
Rot. Bonds2

About 1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine

1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine (PubChem CID 55271130) has the molecular formula C10H15ClN2 and a molecular weight of 198.70 g/mol. Its IUPAC name is 1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine
PubChem CID55271130
Molecular FormulaC10H15ClN2
Molecular Weight198.70 g/mol
Exact Mass198.09
IUPAC Name1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine
SMILESCc1cc(C(N)C(C)C)cc(Cl)n1
InChIInChI=1S/C10H15ClN2/c1-6(2)10(12)8-4-7(3)13-9(11)5-8/h4-6,10H,12H2,1-3H3
InChIKeyCADZGLMLVFEKGB-UHFFFAOYSA-N
XLogP2.70
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.70
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-6-methyl-4-propan-2-ylpyridine
CID 19867375
1-(2-chloro-6-methyl-4-pyridinyl)prop-2-en-1-amine
CID 55291769
1-(2-chloro-4-pyridinyl)-2-methylpropan-1-amine
CID 55294166
(1R)-1-(4-chloro-2,6-dimethyl-3-pyridinyl)-2-methylpropan-1-amine
CID 130619400
3-amino-3-(2-chloro-6-methyl-4-pyridinyl)propanamide;hydrochloride
CID 130718445
4-chloro-6-methyl-N-(3-methylbutan-2-yl)pyrimidin-2-amine
CID 130009210
1-(2,6-dimethyl-4-pyridinyl)ethanamine
CID 82417415
1-(2,6-dimethyl-4-pyridinyl)-2-methylbutan-1-amine
CID 107503239
4-chloro-6-methyl-N-propan-2-ylpyrimidin-2-amine
CID 53385565
2-chloro-4,6-dimethyl(213C,115N)pyridine
CID 130416231
(1R,2R)-1-amino-1-(2-chloro-6-methoxy-4-pyridinyl)propan-2-ol
CID 130632462
(1R)-1-(4-fluoro-3,5-dimethylphenyl)-2-methylpropan-1-amine
CID 55278415

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine?
The IUPAC name of 1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine (CID 55271130) is 1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine.
What is the SMILES notation for 1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine?
The canonical SMILES for 1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine is Cc1cc(C(N)C(C)C)cc(Cl)n1.
What is the InChIKey of 1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine?
The InChIKey is CADZGLMLVFEKGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2/c1-6(2)10(12)8-4-7(3)13-9(11)5-8/h4-6,10H,12H2,1-3H3.
What are the key properties of 1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine?
1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine has a molecular weight of 198.70 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-6-methyl-4-pyridinyl)-2-methylpropan-1-amine is sourced from PubChem (CID 55271130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).