3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine

C14H15Cl2N3 — CID 102756512

IUPAC3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine
SMILESCc1ccccc1CN(C)c1nc(N)c(Cl)cc1Cl
InChIInChI=1S/C14H15Cl2N3/c1-9-5-3-4-6-10(9)8-19(2)14-12(16)7-11(15)13(17)18-14/h3-7H,8H2,1-2H3,(H2,17,18)
InChIKeyMUJJGKPVMHLPRM-UHFFFAOYSA-N
MW296.20 g/mol
LogP3.92
Rot. Bonds3

About 3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine

3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine (PubChem CID 102756512) has the molecular formula C14H15Cl2N3 and a molecular weight of 296.20 g/mol. Its IUPAC name is 3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine.

Molecular Properties

Compound Name3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine
PubChem CID102756512
Molecular FormulaC14H15Cl2N3
Molecular Weight296.20 g/mol
Exact Mass295.06
IUPAC Name3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine
SMILESCc1ccccc1CN(C)c1nc(N)c(Cl)cc1Cl
InChIInChI=1S/C14H15Cl2N3/c1-9-5-3-4-6-10(9)8-19(2)14-12(16)7-11(15)13(17)18-14/h3-7H,8H2,1-2H3,(H2,17,18)
InChIKeyMUJJGKPVMHLPRM-UHFFFAOYSA-N
XLogP3.92
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.20
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridin-2-amine
CID 102761719
2-chloro-4-N-methyl-4-N-[(2-methylphenyl)methyl]pyrimidine-4,5-diamine
CID 114043611
3,5-dichloro-6-N-[(4-methoxyphenyl)methyl]-6-N-methylpyridine-2,6-diamine
CID 102756549
3,5-dichloro-6-N-[2-(dimethylamino)ethyl]-6-N-methylpyridine-2,6-diamine
CID 102758333
3,5-dichloro-6-N-(2,2-dimethylpropyl)-6-N-methylpyridine-2,6-diamine
CID 102757620
1-[(6-amino-3,5-dichloro-2-pyridinyl)-methylamino]propan-2-ol
CID 102757866
3,5-dichloro-6-N-(2,2-difluoroethyl)-6-N-methylpyridine-2,6-diamine
CID 102759999
3-chloro-5-(ethylaminomethyl)-N-methyl-N-[(2-methylphenyl)methyl]pyridin-2-amine
CID 62289541
2-chloro-N,6-dimethyl-N-[(2-methylphenyl)methyl]pyrimidin-4-amine
CID 62481777
3,5-dichloro-6-N-[(2-fluorophenyl)methyl]-2-N,6-N-dimethylpyridine-2,6-diamine
CID 102756516
5-(aminomethyl)-N,3-dimethyl-N-[(2-methylphenyl)methyl]pyridin-2-amine
CID 80629685
4-N-methyl-4-N-[(2-methylphenyl)methyl]benzene-1,4-diamine
CID 28894681

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine?
The IUPAC name of 3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine (CID 102756512) is 3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine.
What is the SMILES notation for 3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine?
The canonical SMILES for 3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine is Cc1ccccc1CN(C)c1nc(N)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine?
The InChIKey is MUJJGKPVMHLPRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2N3/c1-9-5-3-4-6-10(9)8-19(2)14-12(16)7-11(15)13(17)18-14/h3-7H,8H2,1-2H3,(H2,17,18).
What are the key properties of 3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine?
3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine has a molecular weight of 296.20 g/mol, XLogP of 3.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-N-methyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-diamine is sourced from PubChem (CID 102756512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).