7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine

C16H25NO3 — CID 65365816

IUPAC7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine
SMILESCCCNC1CC(C)(C)Oc2cc(OCOC)ccc21
InChIInChI=1S/C16H25NO3/c1-5-8-17-14-10-16(2,3)20-15-9-12(19-11-18-4)6-7-13(14)15/h6-7,9,14,17H,5,8,10-11H2,1-4H3
InChIKeyRRQRPSHTJURJHT-UHFFFAOYSA-N
MW279.38 g/mol
LogP3.27
Rot. Bonds6

About 7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine

7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine (PubChem CID 65365816) has the molecular formula C16H25NO3 and a molecular weight of 279.38 g/mol. Its IUPAC name is 7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine.

Molecular Properties

Compound Name7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine
PubChem CID65365816
Molecular FormulaC16H25NO3
Molecular Weight279.38 g/mol
Exact Mass279.18
IUPAC Name7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine
SMILESCCCNC1CC(C)(C)Oc2cc(OCOC)ccc21
InChIInChI=1S/C16H25NO3/c1-5-8-17-14-10-16(2,3)20-15-9-12(19-11-18-4)6-7-13(14)15/h6-7,9,14,17H,5,8,10-11H2,1-4H3
InChIKeyRRQRPSHTJURJHT-UHFFFAOYSA-N
XLogP3.27
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

7-but-2-ynoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine
CID 62311714
6-methoxy-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine
CID 64698499
7-(methoxymethoxy)-2,2-dimethyl-3,4-dihydrochromen-4-ol
CID 65365060
N-(2-ethylsulfonylethyl)-7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 57258878
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
7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 114711050
2,2-dimethyl-N-propyl-4,6,7,8-tetrahydro-3H-cyclopenta[g]chromen-4-amine
CID 64697481
N-hexyl-2,2,7-trimethyl-3,4-dihydrochromen-4-amine
CID 82461769
7-butoxy-N,2-diethyl-2-methyl-3,4-dihydrochromen-4-amine
CID 82462317
7-methoxy-N-propylspiro[3,4-dihydrochromene-2,3'-thiane]-4-amine
CID 114711066
N-(3-butoxypropyl)-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 115704436

Frequently Asked Questions

What is the IUPAC name of 7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine?
The IUPAC name of 7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine (CID 65365816) is 7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine.
What is the SMILES notation for 7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine?
The canonical SMILES for 7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine is CCCNC1CC(C)(C)Oc2cc(OCOC)ccc21.
What is the InChIKey of 7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine?
The InChIKey is RRQRPSHTJURJHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO3/c1-5-8-17-14-10-16(2,3)20-15-9-12(19-11-18-4)6-7-13(14)15/h6-7,9,14,17H,5,8,10-11H2,1-4H3.
What are the key properties of 7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine?
7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine has a molecular weight of 279.38 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(methoxymethoxy)-2,2-dimethyl-N-propyl-3,4-dihydrochromen-4-amine is sourced from PubChem (CID 65365816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).