6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine

C17H28N2O — CID 79376099

IUPAC6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine
SMILESCCCC(C)N(C)C1Cc2ccc(OC)cc2C1NC
InChIInChI=1S/C17H28N2O/c1-6-7-12(2)19(4)16-10-13-8-9-14(20-5)11-15(13)17(16)18-3/h8-9,11-12,16-18H,6-7,10H2,1-5H3
InChIKeyLXTPAXYHKNQSGI-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.00
Rot. Bonds6

About 6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine

6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine (PubChem CID 79376099) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine.

Molecular Properties

Compound Name6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine
PubChem CID79376099
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine
SMILESCCCC(C)N(C)C1Cc2ccc(OC)cc2C1NC
InChIInChI=1S/C17H28N2O/c1-6-7-12(2)19(4)16-10-13-8-9-14(20-5)11-15(13)17(16)18-3/h8-9,11-12,16-18H,6-7,10H2,1-5H3
InChIKeyLXTPAXYHKNQSGI-UHFFFAOYSA-N
XLogP3.00
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine with MolForge

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Related Compounds

2-N-(cyclopropylmethyl)-6-methoxy-1-N,2-N-dimethyl-2,3-dihydro-1H-indene-1,2-diamine
CID 79376461
6-methoxy-1-N,2-N-dimethyl-2-N-(oxan-4-yl)-2,3-dihydro-1H-indene-1,2-diamine
CID 79370094
1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine
CID 79375098
2-N-cyclopropyl-6-methoxy-2-N-(2-methoxyethyl)-1-N-methyl-2,3-dihydro-1H-indene-1,2-diamine
CID 79370101
2-N-(cyclopropylmethyl)-7-methoxy-1-N,2-N-dimethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 79247986
2-butan-2-ylsulfonyl-6-methoxy-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 79375426
6-methoxy-2-N-(2-methoxyethyl)-2-N-methyl-1-N-propyl-2,3-dihydro-1H-indene-1,2-diamine
CID 79370659
2-N-cyclopentyl-1-N-ethyl-6-methoxy-2-N-methyl-2,3-dihydro-1H-indene-1,2-diamine
CID 79370507
2-N-cyclopentyl-7-methoxy-1-N,2-N-dimethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 79232382
2-[ethyl(2-methylpropyl)amino]-6-methoxy-2,3-dihydro-1H-inden-1-ol
CID 79374084
3-[[6-methoxy-1-(methylamino)-2,3-dihydro-1H-inden-2-yl]sulfanyl]-2-methylpropan-1-ol
CID 79375512
6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 103283356

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine?
The IUPAC name of 6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine (CID 79376099) is 6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine.
What is the SMILES notation for 6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine?
The canonical SMILES for 6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine is CCCC(C)N(C)C1Cc2ccc(OC)cc2C1NC.
What is the InChIKey of 6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine?
The InChIKey is LXTPAXYHKNQSGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-6-7-12(2)19(4)16-10-13-8-9-14(20-5)11-15(13)17(16)18-3/h8-9,11-12,16-18H,6-7,10H2,1-5H3.
What are the key properties of 6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine?
6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine has a molecular weight of 276.42 g/mol, XLogP of 3.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine is sourced from PubChem (CID 79376099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).