6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine

C11H17ClN2 — CID 107272250

IUPAC6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine
SMILESCc1nc(Cl)ccc1NC(C)C(C)C
InChIInChI=1S/C11H17ClN2/c1-7(2)8(3)13-10-5-6-11(12)14-9(10)4/h5-8,13H,1-4H3
InChIKeyRKTIRTRASGKLJK-UHFFFAOYSA-N
MW212.72 g/mol
LogP3.50
Rot. Bonds3

About 6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine

6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine (PubChem CID 107272250) has the molecular formula C11H17ClN2 and a molecular weight of 212.72 g/mol. Its IUPAC name is 6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine
PubChem CID107272250
Molecular FormulaC11H17ClN2
Molecular Weight212.72 g/mol
Exact Mass212.11
IUPAC Name6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine
SMILESCc1nc(Cl)ccc1NC(C)C(C)C
InChIInChI=1S/C11H17ClN2/c1-7(2)8(3)13-10-5-6-11(12)14-9(10)4/h5-8,13H,1-4H3
InChIKeyRKTIRTRASGKLJK-UHFFFAOYSA-N
XLogP3.50
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.72
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine 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

6-chloro-N-[(2S)-1-ethoxypropan-2-yl]-2-methylpyridin-3-amine
CID 99838879
N-[1-(5-bromofuran-2-yl)ethyl]-6-chloro-2-methylpyridin-3-amine
CID 114049353
6-chloro-2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine
CID 114049325
4-[(6-chloro-2-methyl-3-pyridinyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 114049220
6-chloro-2-methyl-N-propan-2-ylpyridine-3-sulfonamide
CID 130552400
4-chloro-6-methyl-N-(3-methylbutan-2-yl)pyrimidin-2-amine
CID 130009210
4-bromo-2-chloro-N-(3-methylbutan-2-yl)aniline
CID 43168155
2-[2-[(6-chloro-2-methyl-3-pyridinyl)amino]ethenyl]propanedioic acid
CID 173127367
2-bromo-4-methyl-N-(3-methylbutan-2-yl)aniline
CID 43099892
2-chloro-N-(3-methylbutan-2-yl)pyrimidin-4-amine
CID 62338504
2-chloro-N-[(2R)-3-methylbutan-2-yl]pyrimidin-4-amine
CID 94405665
5-chloro-N-(6-chloro-2-methyl-3-pyridinyl)pyrazine-2-carboxamide
CID 107329768

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine?
The IUPAC name of 6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine (CID 107272250) is 6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine.
What is the SMILES notation for 6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine?
The canonical SMILES for 6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine is Cc1nc(Cl)ccc1NC(C)C(C)C.
What is the InChIKey of 6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine?
The InChIKey is RKTIRTRASGKLJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2/c1-7(2)8(3)13-10-5-6-11(12)14-9(10)4/h5-8,13H,1-4H3.
What are the key properties of 6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine?
6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine has a molecular weight of 212.72 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine is sourced from PubChem (CID 107272250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).