6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine

C16H26N2O2 — CID 82947826

IUPAC6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine
SMILESCOCCN(C(C)C)C1Cc2ccc(OC)cc2C1N
InChIInChI=1S/C16H26N2O2/c1-11(2)18(7-8-19-3)15-9-12-5-6-13(20-4)10-14(12)16(15)17/h5-6,10-11,15-16H,7-9,17H2,1-4H3
InChIKeyNWECIJZTDHCPAV-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.98
Rot. Bonds6

About 6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine

6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine (PubChem CID 82947826) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine
PubChem CID82947826
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine
SMILESCOCCN(C(C)C)C1Cc2ccc(OC)cc2C1N
InChIInChI=1S/C16H26N2O2/c1-11(2)18(7-8-19-3)15-9-12-5-6-13(20-4)10-14(12)16(15)17/h5-6,10-11,15-16H,7-9,17H2,1-4H3
InChIKeyNWECIJZTDHCPAV-UHFFFAOYSA-N
XLogP1.98
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine?
The IUPAC name of 6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine (CID 82947826) is 6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine.
What is the SMILES notation for 6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine?
The canonical SMILES for 6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine is COCCN(C(C)C)C1Cc2ccc(OC)cc2C1N.
What is the InChIKey of 6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine?
The InChIKey is NWECIJZTDHCPAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-11(2)18(7-8-19-3)15-9-12-5-6-13(20-4)10-14(12)16(15)17/h5-6,10-11,15-16H,7-9,17H2,1-4H3.
What are the key properties of 6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine?
6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine has a molecular weight of 278.40 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-(2-methoxyethyl)-2-N-propan-2-yl-2,3-dihydro-1H-indene-1,2-diamine is sourced from PubChem (CID 82947826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).