N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine

C14H21NO2 — CID 107667267

IUPACN,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine
SMILESCCNC1CCOc2c(OC)cc(CC)cc21
InChIInChI=1S/C14H21NO2/c1-4-10-8-11-12(15-5-2)6-7-17-14(11)13(9-10)16-3/h8-9,12,15H,4-7H2,1-3H3
InChIKeySGIKUOMXOXNJFA-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.69
Rot. Bonds4

About N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine

N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine (PubChem CID 107667267) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine.

Molecular Properties

Compound NameN,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine
PubChem CID107667267
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine
SMILESCCNC1CCOc2c(OC)cc(CC)cc21
InChIInChI=1S/C14H21NO2/c1-4-10-8-11-12(15-5-2)6-7-17-14(11)13(9-10)16-3/h8-9,12,15H,4-7H2,1-3H3
InChIKeySGIKUOMXOXNJFA-UHFFFAOYSA-N
XLogP2.69
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,6-diethyl-8-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 107667295
5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 107667317
N,5-diethyl-7-methoxy-2-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 107667278
6-bromo-N-ethyl-8-methyl-3,4-dihydro-2H-chromen-4-amine
CID 63213338
5-ethyl-7-methoxy-2,3-dihydro-1-benzofuran
CID 170265985
N-benzyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 82461734
N-[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-3,4-dihydro-2H-chromen-4-amine;hydrochloride
CID 56827821
6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 107667337
8-methoxy-N-(pyridin-4-ylmethyl)-3,4-dihydro-2H-chromen-4-amine
CID 82461727
N-ethyl-7,8-dihydro-6H-[1,3]dioxolo[4,5-g]chromen-8-amine
CID 43512405
N-[6-ethyl-8-(1-hydroxy-3-methylbutyl)-3,4-dihydro-2H-chromen-4-yl]acetamide
CID 82175174
N-[6-ethyl-8-(1-hydroxyethyl)-3,4-dihydro-2H-chromen-4-yl]acetamide
CID 82175168

Frequently Asked Questions

What is the IUPAC name of N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine?
The IUPAC name of N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine (CID 107667267) is N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine.
What is the SMILES notation for N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine?
The canonical SMILES for N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine is CCNC1CCOc2c(OC)cc(CC)cc21.
What is the InChIKey of N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine?
The InChIKey is SGIKUOMXOXNJFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-4-10-8-11-12(15-5-2)6-7-17-14(11)13(9-10)16-3/h8-9,12,15H,4-7H2,1-3H3.
What are the key properties of N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine?
N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine has a molecular weight of 235.33 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine is sourced from PubChem (CID 107667267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).