6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine

C15H23NO3 — CID 107667337

IUPAC6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
SMILESCCc1cc(OC)c2c(c1)C(NOC)CC(C)(C)O2
InChIInChI=1S/C15H23NO3/c1-6-10-7-11-12(16-18-5)9-15(2,3)19-14(11)13(8-10)17-4/h7-8,12,16H,6,9H2,1-5H3
InChIKeyLDCSSUZLNWAZED-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.01
Rot. Bonds4

About 6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine

6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine (PubChem CID 107667337) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine.

Molecular Properties

Compound Name6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
PubChem CID107667337
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
SMILESCCc1cc(OC)c2c(c1)C(NOC)CC(C)(C)O2
InChIInChI=1S/C15H23NO3/c1-6-10-7-11-12(16-18-5)9-15(2,3)19-14(11)13(8-10)17-4/h7-8,12,16H,6,9H2,1-5H3
InChIKeyLDCSSUZLNWAZED-UHFFFAOYSA-N
XLogP3.01
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,6-diethyl-8-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 107667295
8-methoxy-2,2,6-trimethyl-N-propyl-3,4-dihydrochromen-4-amine
CID 64696641
6-tert-butyl-N-methoxy-2,2,8-trimethyl-3,4-dihydrochromen-4-amine
CID 81482096
N-methoxy-2,2-dimethyl-3,4-dihydrobenzo[h]chromen-4-amine
CID 81480683
N-ethyl-8-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 64696643
8-iodo-N-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 114287285
N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 107667267
5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 107667317
6-bromo-N-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 81480897
5-ethyl-N,7-dimethoxy-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 107667287
6-fluoro-N-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 81481079
7,8-dimethoxy-N,2,2-trimethyl-3,4-dihydrochromen-4-amine
CID 82462055

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine?
The IUPAC name of 6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine (CID 107667337) is 6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine.
What is the SMILES notation for 6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine?
The canonical SMILES for 6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine is CCc1cc(OC)c2c(c1)C(NOC)CC(C)(C)O2.
What is the InChIKey of 6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine?
The InChIKey is LDCSSUZLNWAZED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-6-10-7-11-12(16-18-5)9-15(2,3)19-14(11)13(8-10)17-4/h7-8,12,16H,6,9H2,1-5H3.
What are the key properties of 6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine?
6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine has a molecular weight of 265.35 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine is sourced from PubChem (CID 107667337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).