2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine

C8H11N — CID 23644178

IUPAC2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine
SMILESC=C1C=CC=C(C)C1N
InChIInChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5,8H,1,9H2,2H3
InChIKeyRFDXLWZZNPOBLL-UHFFFAOYSA-N
MW121.18 g/mol
LogP1.39
Rot. Bonds

About 2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine

2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine (PubChem CID 23644178) has the molecular formula C8H11N and a molecular weight of 121.18 g/mol. Its IUPAC name is 2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine.

Molecular Properties

Compound Name2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine
PubChem CID23644178
Molecular FormulaC8H11N
Molecular Weight121.18 g/mol
Exact Mass121.09
IUPAC Name2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine
SMILESC=C1C=CC=C(C)C1N
InChIInChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5,8H,1,9H2,2H3
InChIKeyRFDXLWZZNPOBLL-UHFFFAOYSA-N
XLogP1.39
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.18
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine?
The IUPAC name of 2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine (CID 23644178) is 2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine.
What is the SMILES notation for 2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine?
The canonical SMILES for 2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine is C=C1C=CC=C(C)C1N.
What is the InChIKey of 2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine?
The InChIKey is RFDXLWZZNPOBLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5,8H,1,9H2,2H3.
What are the key properties of 2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine?
2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine has a molecular weight of 121.18 g/mol, XLogP of 1.39, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-methylidenecyclohexa-2,4-dien-1-amine is sourced from PubChem (CID 23644178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).