3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine

C11H17Cl2N3 — CID 102755851

IUPAC3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine
SMILESCCCN(c1nc(N)c(Cl)cc1Cl)C(C)C
InChIInChI=1S/C11H17Cl2N3/c1-4-5-16(7(2)3)11-9(13)6-8(12)10(14)15-11/h6-7H,4-5H2,1-3H3,(H2,14,15)
InChIKeyCMPDBUFFXAGEBS-UHFFFAOYSA-N
MW262.18 g/mol
LogP3.60
Rot. Bonds4

About 3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine

3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine (PubChem CID 102755851) has the molecular formula C11H17Cl2N3 and a molecular weight of 262.18 g/mol. Its IUPAC name is 3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine.

Molecular Properties

Compound Name3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine
PubChem CID102755851
Molecular FormulaC11H17Cl2N3
Molecular Weight262.18 g/mol
Exact Mass261.08
IUPAC Name3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine
SMILESCCCN(c1nc(N)c(Cl)cc1Cl)C(C)C
InChIInChI=1S/C11H17Cl2N3/c1-4-5-16(7(2)3)11-9(13)6-8(12)10(14)15-11/h6-7H,4-5H2,1-3H3,(H2,14,15)
InChIKeyCMPDBUFFXAGEBS-UHFFFAOYSA-N
XLogP3.60
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.18
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-6-N-propan-2-yl-6-N-(2,2,2-trifluoroethyl)pyridine-2,6-diamine
CID 102757440
3,5-dichloro-6-N-cyclopropyl-6-N-propylpyridine-2,6-diamine
CID 102755856
3,5-dichloro-6-N-propan-2-yl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine
CID 102756801
1-[(6-amino-3,5-dichloro-2-pyridinyl)-methylamino]propan-2-ol
CID 102757866
4-[(6-amino-3,5-dichloro-2-pyridinyl)-methylamino]butan-2-ol
CID 102759983
3,5-dichloro-6-N-[2-(dimethylamino)ethyl]-6-N-methylpyridine-2,6-diamine
CID 102758333
3,5-dichloro-6-N-(2,2-difluoroethyl)-6-N-methylpyridine-2,6-diamine
CID 102759999
3,5-dichloro-6-N-(2,2-dimethylpropyl)-6-N-methylpyridine-2,6-diamine
CID 102757620
3,5-dichloro-6-N-[1-(2-chlorophenyl)ethyl]-6-N-methylpyridine-2,6-diamine
CID 102758072
N-butan-2-yl-N-butyl-3,5-dichloro-6-hydrazinylpyridin-2-amine
CID 102761856
4-(aminomethyl)-3-chloro-N-propan-2-yl-N-propylpyridin-2-amine
CID 107055104
3,5-dichloro-6-(2-methylpropyl)pyridin-2-amine
CID 102753366

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine?
The IUPAC name of 3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine (CID 102755851) is 3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine.
What is the SMILES notation for 3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine?
The canonical SMILES for 3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine is CCCN(c1nc(N)c(Cl)cc1Cl)C(C)C.
What is the InChIKey of 3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine?
The InChIKey is CMPDBUFFXAGEBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17Cl2N3/c1-4-5-16(7(2)3)11-9(13)6-8(12)10(14)15-11/h6-7H,4-5H2,1-3H3,(H2,14,15).
What are the key properties of 3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine?
3,5-dichloro-6-N-propan-2-yl-6-N-propylpyridine-2,6-diamine has a molecular weight of 262.18 g/mol, XLogP of 3.60, 4 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-propan-2-yl-6-N-propylpyridine-2,6-diamine is sourced from PubChem (CID 102755851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).