(3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine

C14H14Cl2N2 — CID 79780865

IUPAC(3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine
SMILESCc1ccc(C(N)c2ncc(Cl)cc2Cl)c(C)c1
InChIInChI=1S/C14H14Cl2N2/c1-8-3-4-11(9(2)5-8)13(17)14-12(16)6-10(15)7-18-14/h3-7,13H,17H2,1-2H3
InChIKeyWONXCGQVZVUXDG-UHFFFAOYSA-N
MW281.19 g/mol
LogP4.05
Rot. Bonds2

About (3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine

(3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine (PubChem CID 79780865) has the molecular formula C14H14Cl2N2 and a molecular weight of 281.19 g/mol. Its IUPAC name is (3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine.

Molecular Properties

Compound Name(3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine
PubChem CID79780865
Molecular FormulaC14H14Cl2N2
Molecular Weight281.19 g/mol
Exact Mass280.05
IUPAC Name(3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine
SMILESCc1ccc(C(N)c2ncc(Cl)cc2Cl)c(C)c1
InChIInChI=1S/C14H14Cl2N2/c1-8-3-4-11(9(2)5-8)13(17)14-12(16)6-10(15)7-18-14/h3-7,13H,17H2,1-2H3
InChIKeyWONXCGQVZVUXDG-UHFFFAOYSA-N
XLogP4.05
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.19
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-chloro-4-methylphenyl)-(3,5-dichloro-2-pyridinyl)methanamine
CID 107560529
(2-chloro-5-fluorophenyl)-(3,5-dichloro-2-pyridinyl)methanamine
CID 105395259
2-(2-chloro-4-methylphenyl)-1-(3,5-dichloro-2-pyridinyl)ethanamine
CID 106868543
(4-chlorophenyl)-(2,4-dimethylphenyl)methanamine
CID 43198498
(3,5-dichlorophenyl)-(2,4-dimethylphenyl)methanamine
CID 43096001
(3,5-dichloro-2-pyridinyl)-[4-(trifluoromethyl)-3-pyridinyl]methanamine
CID 102708360
(2-chloro-4-fluoro-5-methylphenyl)-(2,4-dimethylphenyl)methanamine
CID 81045582
(3-bromo-4-chlorophenyl)-(2,4-dimethylphenyl)methanamine
CID 113337076
(5-bromo-4-chlorothiophen-2-yl)-(2,4-dimethylphenyl)methanamine
CID 80530680
(2,4-dimethylphenyl)-(2-methylphenyl)methanamine
CID 43198494
(4-chloro-1-propylpyrazol-5-yl)-(2,4-dimethylphenyl)methanamine
CID 105042475
1-(3,5-dichloro-2-pyridinyl)-N-methyl-1-(5-methyl-1-benzofuran-2-yl)methanamine
CID 114729955

Frequently Asked Questions

What is the IUPAC name of (3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine?
The IUPAC name of (3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine (CID 79780865) is (3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine.
What is the SMILES notation for (3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine?
The canonical SMILES for (3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine is Cc1ccc(C(N)c2ncc(Cl)cc2Cl)c(C)c1.
What is the InChIKey of (3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine?
The InChIKey is WONXCGQVZVUXDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2/c1-8-3-4-11(9(2)5-8)13(17)14-12(16)6-10(15)7-18-14/h3-7,13H,17H2,1-2H3.
What are the key properties of (3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine?
(3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine has a molecular weight of 281.19 g/mol, XLogP of 4.05, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichloro-2-pyridinyl)-(2,4-dimethylphenyl)methanamine is sourced from PubChem (CID 79780865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).