4,6-dimethyl-2,3-dihydrochromen-4-amine

C11H15NO — CID 82194374

IUPAC4,6-dimethyl-2,3-dihydrochromen-4-amine
SMILESCc1ccc2c(c1)C(C)(N)CCO2
InChIInChI=1S/C11H15NO/c1-8-3-4-10-9(7-8)11(2,12)5-6-13-10/h3-4,7H,5-6,12H2,1-2H3
InChIKeyRIGSQPCJDJLDGM-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.95
Rot. Bonds

About 4,6-dimethyl-2,3-dihydrochromen-4-amine

4,6-dimethyl-2,3-dihydrochromen-4-amine (PubChem CID 82194374) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 4,6-dimethyl-2,3-dihydrochromen-4-amine.

Molecular Properties

Compound Name4,6-dimethyl-2,3-dihydrochromen-4-amine
PubChem CID82194374
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name4,6-dimethyl-2,3-dihydrochromen-4-amine
SMILESCc1ccc2c(c1)C(C)(N)CCO2
InChIInChI=1S/C11H15NO/c1-8-3-4-10-9(7-8)11(2,12)5-6-13-10/h3-4,7H,5-6,12H2,1-2H3
InChIKeyRIGSQPCJDJLDGM-UHFFFAOYSA-N
XLogP1.95
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2,3-dihydrochromen-4-amine?
The IUPAC name of 4,6-dimethyl-2,3-dihydrochromen-4-amine (CID 82194374) is 4,6-dimethyl-2,3-dihydrochromen-4-amine.
What is the SMILES notation for 4,6-dimethyl-2,3-dihydrochromen-4-amine?
The canonical SMILES for 4,6-dimethyl-2,3-dihydrochromen-4-amine is Cc1ccc2c(c1)C(C)(N)CCO2.
What is the InChIKey of 4,6-dimethyl-2,3-dihydrochromen-4-amine?
The InChIKey is RIGSQPCJDJLDGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-8-3-4-10-9(7-8)11(2,12)5-6-13-10/h3-4,7H,5-6,12H2,1-2H3.
What are the key properties of 4,6-dimethyl-2,3-dihydrochromen-4-amine?
4,6-dimethyl-2,3-dihydrochromen-4-amine has a molecular weight of 177.25 g/mol, XLogP of 1.95, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2,3-dihydrochromen-4-amine is sourced from PubChem (CID 82194374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).