6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine

C11H15ClN2 — CID 167100568

IUPAC6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine
SMILESC=C(C)CNc1cc(C)c(Cl)nc1C
InChIInChI=1S/C11H15ClN2/c1-7(2)6-13-10-5-8(3)11(12)14-9(10)4/h5,13H,1,6H2,2-4H3
InChIKeyWUUNISWKOCHBHM-UHFFFAOYSA-N
MW210.71 g/mol
LogP3.34
Rot. Bonds3

About 6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine

6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine (PubChem CID 167100568) has the molecular formula C11H15ClN2 and a molecular weight of 210.71 g/mol. Its IUPAC name is 6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine.

Molecular Properties

Compound Name6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine
PubChem CID167100568
Molecular FormulaC11H15ClN2
Molecular Weight210.71 g/mol
Exact Mass210.09
IUPAC Name6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine
SMILESC=C(C)CNc1cc(C)c(Cl)nc1C
InChIInChI=1S/C11H15ClN2/c1-7(2)6-13-10-5-8(3)11(12)14-9(10)4/h5,13H,1,6H2,2-4H3
InChIKeyWUUNISWKOCHBHM-UHFFFAOYSA-N
XLogP3.34
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.71
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-fluoro-5-methyl-1-N-(2-methylprop-2-enyl)benzene-1,2-diamine
CID 103590813
(6-chloro-2,5-dimethyl-3-pyridinyl)methanol
CID 130047173
3-chloro-N-(2-methylprop-2-enyl)pyrazin-2-amine
CID 106196773
6-methyl-4-(2-methylprop-2-enylamino)pyridine-2-carboxylic acid
CID 131048994
2-methyl-N-(2-methylprop-2-enyl)-5-(trifluoromethyl)aniline
CID 66481146
6-chloro-5-methyl-N-(2-methylprop-2-enyl)-2-propan-2-ylpyrimidin-4-amine
CID 106196742
2-chloro-6-(2-methylprop-2-enylamino)pyridine-4-carbonitrile
CID 106196714
6-methyl-2-(2-methylprop-2-enylamino)pyrimidine-4-carboxylic acid
CID 107554495
4-chloro-N-(2-methylprop-2-enyl)-1,2,5-thiadiazol-3-amine
CID 106196771
6-chloro-2-cyclopropyl-N-(2-methylprop-2-enyl)pyrimidin-4-amine
CID 104952861
2-chloro-6-(2-methylprop-2-enylamino)pyridine-4-carboxylic acid
CID 114617465
2-methoxy-5-methyl-N-(2-methylprop-2-enyl)aniline
CID 60679323

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine?
The IUPAC name of 6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine (CID 167100568) is 6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine.
What is the SMILES notation for 6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine?
The canonical SMILES for 6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine is C=C(C)CNc1cc(C)c(Cl)nc1C.
What is the InChIKey of 6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine?
The InChIKey is WUUNISWKOCHBHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2/c1-7(2)6-13-10-5-8(3)11(12)14-9(10)4/h5,13H,1,6H2,2-4H3.
What are the key properties of 6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine?
6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine has a molecular weight of 210.71 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2,5-dimethyl-N-(2-methylprop-2-enyl)pyridin-3-amine is sourced from PubChem (CID 167100568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).