(4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine

C13H19NO — CID 42220652

IUPAC(4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine
SMILESCc1cc2c(cc1C)[C@H](N)CC(C)(C)O2
InChIInChI=1S/C13H19NO/c1-8-5-10-11(14)7-13(3,4)15-12(10)6-9(8)2/h5-6,11H,7,14H2,1-4H3/t11-/m1/s1
InChIKeyQYFREVFIVRIKQH-LLVKDONJSA-N
MW205.30 g/mol
LogP2.86
Rot. Bonds

About (4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine

(4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine (PubChem CID 42220652) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine.

Molecular Properties

Compound Name(4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine
PubChem CID42220652
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine
SMILESCc1cc2c(cc1C)[C@H](N)CC(C)(C)O2
InChIInChI=1S/C13H19NO/c1-8-5-10-11(14)7-13(3,4)15-12(10)6-9(8)2/h5-6,11H,7,14H2,1-4H3/t11-/m1/s1
InChIKeyQYFREVFIVRIKQH-LLVKDONJSA-N
XLogP2.86
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine;hydrochloride
CID 162328196
(4S)-2,2,7-trimethyl-3,4-dihydrochromen-4-amine
CID 42220633
2,2,7-trimethyl-3,4-dihydrochromen-4-amine;hydrochloride
CID 46736559
(4S)-7-bromo-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 97050676
6-tert-butyl-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 64696862
(4S)-6-ethyl-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 42220642
2,2-dimethyl-7-(trifluoromethoxy)-3,4-dihydrochromen-4-amine
CID 68595948
8-bromo-2,2,6-trimethyl-3,4-dihydrochromen-4-amine
CID 64696649
2,2-dimethyl-7-(3,3,3-trifluoropropoxy)-3,4-dihydrochromen-4-amine
CID 64553531
(4S)-4-amino-2,2-dimethyl-3,4-dihydrochromen-8-ol
CID 130778486
(4R)-7,8-difluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 68595471
6,7-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-ol
CID 14334290

Frequently Asked Questions

What is the IUPAC name of (4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine?
The IUPAC name of (4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine (CID 42220652) is (4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine.
What is the SMILES notation for (4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine?
The canonical SMILES for (4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine is Cc1cc2c(cc1C)[C@H](N)CC(C)(C)O2.
What is the InChIKey of (4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine?
The InChIKey is QYFREVFIVRIKQH-LLVKDONJSA-N. The full InChI is InChI=1S/C13H19NO/c1-8-5-10-11(14)7-13(3,4)15-12(10)6-9(8)2/h5-6,11H,7,14H2,1-4H3/t11-/m1/s1.
What are the key properties of (4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine?
(4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine has a molecular weight of 205.30 g/mol, XLogP of 2.86, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2,2,6,7-tetramethyl-3,4-dihydrochromen-4-amine is sourced from PubChem (CID 42220652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).