6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine

C17H27NO2 — CID 114712983

IUPAC6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine
SMILESCCCC1(CCC)CC(NC)c2cc(OC)ccc2O1
InChIInChI=1S/C17H27NO2/c1-5-9-17(10-6-2)12-15(18-3)14-11-13(19-4)7-8-16(14)20-17/h7-8,11,15,18H,5-6,9-10,12H2,1-4H3
InChIKeyFHWAJKGZDUQGQQ-UHFFFAOYSA-N
MW277.41 g/mol
LogP4.08
Rot. Bonds6

About 6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine

6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine (PubChem CID 114712983) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine.

Molecular Properties

Compound Name6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine
PubChem CID114712983
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine
SMILESCCCC1(CCC)CC(NC)c2cc(OC)ccc2O1
InChIInChI=1S/C17H27NO2/c1-5-9-17(10-6-2)12-15(18-3)14-11-13(19-4)7-8-16(14)20-17/h7-8,11,15,18H,5-6,9-10,12H2,1-4H3
InChIKeyFHWAJKGZDUQGQQ-UHFFFAOYSA-N
XLogP4.08
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine
CID 114710932
2,2-diethyl-6-methoxy-N-methyl-3,4-dihydrochromen-4-amine
CID 82462579
(4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol
CID 104951003
N-butyl-2,2-diethyl-6-methoxy-3,4-dihydrochromen-4-amine
CID 82462581
2-ethyl-6-methoxy-2-(methoxymethyl)-N-propyl-3,4-dihydrochromen-4-amine
CID 114713126
2-(cyclobutylmethyl)-6-methoxy-N,2-dimethyl-3,4-dihydrochromen-4-amine
CID 114712937
6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine
CID 64698499
2-butyl-2-ethyl-6-methoxy-3,4-dihydrochromen-4-ol
CID 114715453
2-cyclopropyl-6-methoxy-N-methyl-3,4-dihydro-2H-chromen-4-amine
CID 114712990
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
6-methoxy-N-propylspiro[3,4-dihydrochromene-2,3'-oxolane]-4-amine
CID 114713119

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine?
The IUPAC name of 6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine (CID 114712983) is 6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine.
What is the SMILES notation for 6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine?
The canonical SMILES for 6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine is CCCC1(CCC)CC(NC)c2cc(OC)ccc2O1.
What is the InChIKey of 6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine?
The InChIKey is FHWAJKGZDUQGQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-5-9-17(10-6-2)12-15(18-3)14-11-13(19-4)7-8-16(14)20-17/h7-8,11,15,18H,5-6,9-10,12H2,1-4H3.
What are the key properties of 6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine?
6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine has a molecular weight of 277.41 g/mol, XLogP of 4.08, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine is sourced from PubChem (CID 114712983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).