1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine

C12H17NO — CID 105445390

IUPAC1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine
SMILESCNCC1Cc2cccc(OC)c2C1
InChIInChI=1S/C12H17NO/c1-13-8-9-6-10-4-3-5-12(14-2)11(10)7-9/h3-5,9,13H,6-8H2,1-2H3
InChIKeyYJJHQUFWQIKOGC-UHFFFAOYSA-N
MW191.27 g/mol
LogP1.63
Rot. Bonds3

About 1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine

1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine (PubChem CID 105445390) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine
PubChem CID105445390
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine
SMILESCNCC1Cc2cccc(OC)c2C1
InChIInChI=1S/C12H17NO/c1-13-8-9-6-10-4-3-5-12(14-2)11(10)7-9/h3-5,9,13H,6-8H2,1-2H3
InChIKeyYJJHQUFWQIKOGC-UHFFFAOYSA-N
XLogP1.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)-N-methylmethanamine
CID 112547016
5-methoxy-1,2,3,4-tetrahydronaphthalene-2,3-diol
CID 123352888
(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine;hydrochloride
CID 19888691
N-(cyclopropylmethyl)-8-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 18331788
1-(7-methoxy-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine
CID 83860483
methyl 2-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)acetate
CID 15237997
methyl (2R)-4-methoxy-2,3-dihydro-1H-indene-2-carboxylate
CID 86315719
ethane;5-methoxy-N-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 165394416
1-(8-methoxy-1,2,3,4-tetrahydroquinolin-2-yl)-N-methylmethanamine
CID 84620735
(2R,3S)-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 130898771
(3aR,9aR)-5-methoxy-2,3,3a,4,9,9a-hexahydro-1H-benzo[f]isoindole
CID 11030912
1-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)-N-methylethanamine
CID 105474792

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine (CID 105445390) is 1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine is CNCC1Cc2cccc(OC)c2C1.
What is the InChIKey of 1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine?
The InChIKey is YJJHQUFWQIKOGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-13-8-9-6-10-4-3-5-12(14-2)11(10)7-9/h3-5,9,13H,6-8H2,1-2H3.
What are the key properties of 1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine?
1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine has a molecular weight of 191.27 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine is sourced from PubChem (CID 105445390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).