6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine

C17H25NO — CID 103903344

IUPAC6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine
SMILESCc1ccc2c(c1)C(NCC1(C)CCOCC1)CC2
InChIInChI=1S/C17H25NO/c1-13-3-4-14-5-6-16(15(14)11-13)18-12-17(2)7-9-19-10-8-17/h3-4,11,16,18H,5-10,12H2,1-2H3
InChIKeyZHCADPVIFNCNLF-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.39
Rot. Bonds3

About 6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine

6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine (PubChem CID 103903344) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine
PubChem CID103903344
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine
SMILESCc1ccc2c(c1)C(NCC1(C)CCOCC1)CC2
InChIInChI=1S/C17H25NO/c1-13-3-4-14-5-6-16(15(14)11-13)18-12-17(2)7-9-19-10-8-17/h3-4,11,16,18H,5-10,12H2,1-2H3
InChIKeyZHCADPVIFNCNLF-UHFFFAOYSA-N
XLogP3.39
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-methyl-N-(3-morpholin-4-ylpropyl)-2,3-dihydro-1H-inden-1-amine
CID 81300518
4-bromo-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine
CID 103846495
(1S)-N-(2-methoxyethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 97357930
4-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]butan-1-ol
CID 106840528
N-[(5-chlorothiophen-2-yl)methyl]-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 78948024
N-[(2-fluorophenyl)methyl]-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 78948023
6-bromo-N-[(4-methyloxan-4-yl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 103903298
6-methyl-N-(2-pyrrolidin-1-ylethyl)-2,3-dihydro-1H-inden-1-amine
CID 81301273
N-cyclopropyl-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 75488646
5-[(4-methyloxan-4-yl)methylamino]-5,6,7,8-tetrahydro-1H-quinolin-2-one
CID 103903395
7-methoxy-N-[(1-methylcyclobutyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 103903212
1-[(1,4-dimethylpiperidin-4-yl)methylamino]-2,3-dihydro-1H-inden-5-ol
CID 107682738

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine (CID 103903344) is 6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine is Cc1ccc2c(c1)C(NCC1(C)CCOCC1)CC2.
What is the InChIKey of 6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
The InChIKey is ZHCADPVIFNCNLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-13-3-4-14-5-6-16(15(14)11-13)18-12-17(2)7-9-19-10-8-17/h3-4,11,16,18H,5-10,12H2,1-2H3.
What are the key properties of 6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine has a molecular weight of 259.39 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(4-methyloxan-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 103903344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).