N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine

C19H32N2O — CID 82461834

IUPACN',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNC1CC(C)(C)Oc2c1ccc(C)c2C
InChIInChI=1S/C19H32N2O/c1-7-21(8-2)12-11-20-17-13-19(5,6)22-18-15(4)14(3)9-10-16(17)18/h9-10,17,20H,7-8,11-13H2,1-6H3
InChIKeyGZNSQSNBELEEPG-UHFFFAOYSA-N
MW304.48 g/mol
LogP3.84
Rot. Bonds6

About N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine

N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine (PubChem CID 82461834) has the molecular formula C19H32N2O and a molecular weight of 304.48 g/mol. Its IUPAC name is N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine
PubChem CID82461834
Molecular FormulaC19H32N2O
Molecular Weight304.48 g/mol
Exact Mass304.25
IUPAC NameN',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNC1CC(C)(C)Oc2c1ccc(C)c2C
InChIInChI=1S/C19H32N2O/c1-7-21(8-2)12-11-20-17-13-19(5,6)22-18-15(4)14(3)9-10-16(17)18/h9-10,17,20H,7-8,11-13H2,1-6H3
InChIKeyGZNSQSNBELEEPG-UHFFFAOYSA-N
XLogP3.84
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.48
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine?
The IUPAC name of N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine (CID 82461834) is N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine?
The canonical SMILES for N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine is CCN(CC)CCNC1CC(C)(C)Oc2c1ccc(C)c2C.
What is the InChIKey of N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine?
The InChIKey is GZNSQSNBELEEPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2O/c1-7-21(8-2)12-11-20-17-13-19(5,6)22-18-15(4)14(3)9-10-16(17)18/h9-10,17,20H,7-8,11-13H2,1-6H3.
What are the key properties of N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine?
N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine has a molecular weight of 304.48 g/mol, XLogP of 3.84, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-(2,2,7,8-tetramethyl-3,4-dihydrochromen-4-yl)ethane-1,2-diamine is sourced from PubChem (CID 82461834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).