3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine

C14H21Cl2N3 — CID 102758204

IUPAC3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine
SMILESCNc1nc(NCC2CCC(C)CC2)c(Cl)cc1Cl
InChIInChI=1S/C14H21Cl2N3/c1-9-3-5-10(6-4-9)8-18-14-12(16)7-11(15)13(17-2)19-14/h7,9-10H,3-6,8H2,1-2H3,(H2,17,18,19)
InChIKeyOCYGEVHHCVBDLR-UHFFFAOYSA-N
MW302.25 g/mol
LogP4.67
Rot. Bonds4

About 3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine

3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine (PubChem CID 102758204) has the molecular formula C14H21Cl2N3 and a molecular weight of 302.25 g/mol. Its IUPAC name is 3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine.

Molecular Properties

Compound Name3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine
PubChem CID102758204
Molecular FormulaC14H21Cl2N3
Molecular Weight302.25 g/mol
Exact Mass301.11
IUPAC Name3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine
SMILESCNc1nc(NCC2CCC(C)CC2)c(Cl)cc1Cl
InChIInChI=1S/C14H21Cl2N3/c1-9-3-5-10(6-4-9)8-18-14-12(16)7-11(15)13(17-2)19-14/h7,9-10H,3-6,8H2,1-2H3,(H2,17,18,19)
InChIKeyOCYGEVHHCVBDLR-UHFFFAOYSA-N
XLogP4.67
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.25
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-6-N-(cyclobutylmethyl)-2-N-propylpyridine-2,6-diamine
CID 102755904
5-bromo-3-chloro-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine
CID 103582514
6-chloro-4-N-methyl-2-N-[(4-methylcyclohexyl)methyl]pyrimidine-2,4-diamine
CID 145055889
3,5-dichloro-6-N-(1-cyclopropylpropan-2-yl)-2-N-methylpyridine-2,6-diamine
CID 102758446
6-chloro-N-[(4-methylcyclohexyl)methyl]-3-nitropyridin-2-amine
CID 63549781
3,5-dichloro-6-N-decyl-2-N-methylpyridine-2,6-diamine
CID 102759054
4-chloro-N-[(4-methylcyclohexyl)methyl]-1,2,5-thiadiazol-3-amine
CID 63549782
1-[[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]methyl]-3-methylcyclohexan-1-ol
CID 102758689
1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol
CID 102758667
3,5-dichloro-2-N-methyl-6-N-[2-(oxolan-3-yl)ethyl]pyridine-2,6-diamine
CID 114131325
3,5-dichloro-6-N-[2-(dimethylamino)ethyl]-2-N-methylpyridine-2,6-diamine
CID 102755513
6-chloro-2-ethyl-5-methyl-N-[(4-methylcyclohexyl)methyl]pyrimidin-4-amine
CID 80972098

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine?
The IUPAC name of 3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine (CID 102758204) is 3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine.
What is the SMILES notation for 3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine?
The canonical SMILES for 3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine is CNc1nc(NCC2CCC(C)CC2)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine?
The InChIKey is OCYGEVHHCVBDLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21Cl2N3/c1-9-3-5-10(6-4-9)8-18-14-12(16)7-11(15)13(17-2)19-14/h7,9-10H,3-6,8H2,1-2H3,(H2,17,18,19).
What are the key properties of 3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine?
3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine has a molecular weight of 302.25 g/mol, XLogP of 4.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-2-N-methyl-6-N-[(4-methylcyclohexyl)methyl]pyridine-2,6-diamine is sourced from PubChem (CID 102758204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).