6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine

C15H23NO2 — CID 64698499

IUPAC6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine
SMILESCCCNC1CC(C)(C)Oc2ccc(OC)cc21
InChIInChI=1S/C15H23NO2/c1-5-8-16-13-10-15(2,3)18-14-7-6-11(17-4)9-12(13)14/h6-7,9,13,16H,5,8,10H2,1-4H3
InChIKeyBURVYFFBOQLANW-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.30
Rot. Bonds4

About 6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine

6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine (PubChem CID 64698499) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine.

Molecular Properties

Compound Name6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine
PubChem CID64698499
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine
SMILESCCCNC1CC(C)(C)Oc2ccc(OC)cc21
InChIInChI=1S/C15H23NO2/c1-5-8-16-13-10-15(2,3)18-14-7-6-11(17-4)9-12(13)14/h6-7,9,13,16H,5,8,10H2,1-4H3
InChIKeyBURVYFFBOQLANW-UHFFFAOYSA-N
XLogP3.30
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methoxy-2,2-dimethyl-N-(3-methylbutyl)-3,4-dihydrochromen-4-amine
CID 82461976
6-methoxy-N-propylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 114713133
3',6-dimethoxy-N-propylspiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-amine
CID 106825146
2-ethyl-6-methoxy-2-(methoxymethyl)-N-propyl-3,4-dihydrochromen-4-amine
CID 114713126
1-[(4R)-6-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-3-propylurea
CID 100748889
6-methoxy-N-propylspiro[3,4-dihydrochromene-2,3'-oxolane]-4-amine
CID 114713119
N-butyl-2,2-dimethyl-6-propoxy-3,4-dihydrochromen-4-amine
CID 82461986
6-ethoxy-N-hexyl-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 82461979
N-butyl-2,2-diethyl-6-methoxy-3,4-dihydrochromen-4-amine
CID 82462581
N-(2-ethylsulfonylethyl)-7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 57258878
7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine
CID 65365816
N-[(4S)-6-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-2-methylpropanamide
CID 95875389

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine?
The IUPAC name of 6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine (CID 64698499) is 6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine.
What is the SMILES notation for 6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine?
The canonical SMILES for 6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine is CCCNC1CC(C)(C)Oc2ccc(OC)cc21.
What is the InChIKey of 6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine?
The InChIKey is BURVYFFBOQLANW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-5-8-16-13-10-15(2,3)18-14-7-6-11(17-4)9-12(13)14/h6-7,9,13,16H,5,8,10H2,1-4H3.
What are the key properties of 6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine?
6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine has a molecular weight of 249.35 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine is sourced from PubChem (CID 64698499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).