1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine

C16H26N2O — CID 79375098

IUPAC1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine
SMILESCCCN(C)C1Cc2ccc(OC)cc2C1NCC
InChIInChI=1S/C16H26N2O/c1-5-9-18(3)15-10-12-7-8-13(19-4)11-14(12)16(15)17-6-2/h7-8,11,15-17H,5-6,9-10H2,1-4H3
InChIKeyHEEDAIFKLKIIIC-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.61
Rot. Bonds6

About 1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine

1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine (PubChem CID 79375098) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine.

Molecular Properties

Compound Name1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine
PubChem CID79375098
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine
SMILESCCCN(C)C1Cc2ccc(OC)cc2C1NCC
InChIInChI=1S/C16H26N2O/c1-5-9-18(3)15-10-12-7-8-13(19-4)11-14(12)16(15)17-6-2/h7-8,11,15-17H,5-6,9-10H2,1-4H3
InChIKeyHEEDAIFKLKIIIC-UHFFFAOYSA-N
XLogP2.61
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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
N-ethyl-2-ethylsulfanyl-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79368198
2-N-(cyclopropylmethyl)-6-methoxy-1-N,2-N-dimethyl-2,3-dihydro-1H-indene-1,2-diamine
CID 79376461
N-ethyl-6-methoxy-2-propylsulfonyl-2,3-dihydro-1H-inden-1-amine
CID 79375167
6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine
CID 79376099
N-ethyl-6-methoxy-2-(2-methylpyrrolidin-1-yl)-2,3-dihydro-1H-inden-1-amine
CID 79374745
N-ethyl-6-methoxy-2-(2-methylbutylsulfanyl)-2,3-dihydro-1H-inden-1-amine
CID 107763601
1-N-ethyl-2-N-(3-methoxypropyl)-2-N-methyl-2,3-dihydro-1H-indene-1,2-diamine
CID 55139716
(1R,2R)-5-methoxy-N-methyl-1-phenyl-N-propyl-2,3-dihydro-1H-inden-2-amine
CID 10494111
[1-(ethylamino)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methanol
CID 79248721
2-N-(2-ethoxyethyl)-1-N-ethyl-2-N-methyl-2,3-dihydro-1H-indene-1,2-diamine
CID 81059440

Frequently Asked Questions

What is the IUPAC name of 1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine?
The IUPAC name of 1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine (CID 79375098) is 1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine.
What is the SMILES notation for 1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine?
The canonical SMILES for 1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine is CCCN(C)C1Cc2ccc(OC)cc2C1NCC.
What is the InChIKey of 1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine?
The InChIKey is HEEDAIFKLKIIIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-5-9-18(3)15-10-12-7-8-13(19-4)11-14(12)16(15)17-6-2/h7-8,11,15-17H,5-6,9-10H2,1-4H3.
What are the key properties of 1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine?
1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine has a molecular weight of 262.40 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-ethyl-6-methoxy-2-N-methyl-2-N-propyl-2,3-dihydro-1H-indene-1,2-diamine is sourced from PubChem (CID 79375098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).