4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine

C14H19N — CID 153344986

IUPAC4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine
SMILESCC1=CC=C(NC2=CC=C(C)CC2)CC1
InChIInChI=1S/C14H19N/c1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14/h3,5,7,9,15H,4,6,8,10H2,1-2H3
InChIKeyFMCOUUJSGUAZCE-UHFFFAOYSA-N
MW201.31 g/mol
LogP3.82
Rot. Bonds2

About 4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine

4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine (PubChem CID 153344986) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine.

Molecular Properties

Compound Name4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine
PubChem CID153344986
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine
SMILESCC1=CC=C(NC2=CC=C(C)CC2)CC1
InChIInChI=1S/C14H19N/c1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14/h3,5,7,9,15H,4,6,8,10H2,1-2H3
InChIKeyFMCOUUJSGUAZCE-UHFFFAOYSA-N
XLogP3.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)aniline
CID 144542686
N-ethenyl-4-methylcyclohexa-1,3-dien-1-amine
CID 143015528
ethane;N-(4-methylcyclohexa-1,3-dien-1-yl)methanesulfinamide
CID 163229347
4-methyl-N-[4-[1-methyl-5-[4-[(4-methylcyclohexa-1,3-dien-1-yl)amino]phenyl]pyrrol-2-yl]phenyl]aniline
CID 154692023
1,4-dimethylcyclohexa-1,3-diene;1,4-xylene
CID 142004310
1-(4-methylanilino)-4-[(4-methylcyclohexa-1,3-dien-1-yl)amino]anthracene-9,10-dione
CID 144649233
1-methyl-4-[2-(4-methylcyclohexa-1,3-dien-1-yl)ethyl]cyclohexa-1,3-diene
CID 123323176
methane;4-methylcyclohexa-1,3-dien-1-ol
CID 142050116
1-chloro-4-methylcyclohexa-1,3-diene;ethane
CID 143258352
6-methyl-4-N-(4-methylcyclohepta-1,3-dien-1-yl)pyrimidine-2,4-diamine
CID 142995172
ethane;methanamine;4-methylcyclohexa-1,3-dien-1-amine
CID 143366498
CID 142144499
CID 142144499

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine?
The IUPAC name of 4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine (CID 153344986) is 4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine.
What is the SMILES notation for 4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine?
The canonical SMILES for 4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine is CC1=CC=C(NC2=CC=C(C)CC2)CC1.
What is the InChIKey of 4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine?
The InChIKey is FMCOUUJSGUAZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14/h3,5,7,9,15H,4,6,8,10H2,1-2H3.
What are the key properties of 4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine?
4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine has a molecular weight of 201.31 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)cyclohexa-1,3-dien-1-amine is sourced from PubChem (CID 153344986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).