3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine

C18H26N2 — CID 115376237

IUPAC3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine
SMILESCN(C)c1cccc(NC2CC3CC2C2CCCC32)c1
InChIInChI=1S/C18H26N2/c1-20(2)14-6-3-5-13(11-14)19-18-10-12-9-17(18)16-8-4-7-15(12)16/h3,5-6,11-12,15-19H,4,7-10H2,1-2H3
InChIKeyKEBFXHCSSZTXAH-UHFFFAOYSA-N
MW270.42 g/mol
LogP3.99
Rot. Bonds3

About 3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine

3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine (PubChem CID 115376237) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine
PubChem CID115376237
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC Name3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine
SMILESCN(C)c1cccc(NC2CC3CC2C2CCCC32)c1
InChIInChI=1S/C18H26N2/c1-20(2)14-6-3-5-13(11-14)19-18-10-12-9-17(18)16-8-4-7-15(12)16/h3,5-6,11-12,15-19H,4,7-10H2,1-2H3
InChIKeyKEBFXHCSSZTXAH-UHFFFAOYSA-N
XLogP3.99
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine with MolForge

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Related Compounds

2-chloro-1-N,1-N-dimethyl-4-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,4-diamine
CID 63451178
N-(3-methylsulfonylphenyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 60923902
2-N,2-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,2-diamine
CID 43726475
3-N,3-N-dimethyl-1-N-(2-piperidin-2-ylcyclopentyl)benzene-1,3-diamine
CID 115376568
N-(8-tricyclo[5.2.1.02,6]decanyl)-2,3-dihydro-1,4-benzodioxin-6-amine
CID 43503174
N-(3-fluoro-4-methylphenyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 43503194
2-fluoro-5-(8-tricyclo[5.2.1.02,6]decanylamino)benzonitrile
CID 63477105
N-[2-[(dimethylamino)methyl]phenyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 43750113
5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine
CID 107584885
1-N-(3-aminocyclobutyl)-3-N,3-N-dimethylbenzene-1,3-diamine
CID 115376113
N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine
CID 43503137
N-(4-bromo-3-nitrophenyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 79760146

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine?
The IUPAC name of 3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine (CID 115376237) is 3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine is CN(C)c1cccc(NC2CC3CC2C2CCCC32)c1.
What is the InChIKey of 3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine?
The InChIKey is KEBFXHCSSZTXAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2/c1-20(2)14-6-3-5-13(11-14)19-18-10-12-9-17(18)16-8-4-7-15(12)16/h3,5-6,11-12,15-19H,4,7-10H2,1-2H3.
What are the key properties of 3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine?
3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine has a molecular weight of 270.42 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine is sourced from PubChem (CID 115376237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).