2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol

C12H17NO — CID 130905101

IUPAC2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol
SMILESCC1(NCCO)CCc2ccccc21
InChIInChI=1S/C12H17NO/c1-12(13-8-9-14)7-6-10-4-2-3-5-11(10)12/h2-5,13-14H,6-9H2,1H3
InChIKeyZBSFDNSQAXVZNB-UHFFFAOYSA-N
MW191.27 g/mol
LogP1.43
Rot. Bonds3

About 2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol

2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol (PubChem CID 130905101) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol
PubChem CID130905101
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol
SMILESCC1(NCCO)CCc2ccccc21
InChIInChI=1S/C12H17NO/c1-12(13-8-9-14)7-6-10-4-2-3-5-11(10)12/h2-5,13-14H,6-9H2,1H3
InChIKeyZBSFDNSQAXVZNB-UHFFFAOYSA-N
XLogP1.43
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl N-(1-methyl-2,3-dihydroinden-1-yl)carbamate
CID 145156027
3,3-dimethyl-N-[(1S)-1-methyl-2,3-dihydroinden-1-yl]butanamide
CID 122550804
[1-(ethylamino)-2,3-dihydroinden-1-yl]methanol
CID 61050687
propan-2-yl N-[(1S)-1-methyl-2,3-dihydroinden-1-yl]carbamate
CID 122550821
3-methyl-3-propyl-1,2-dihydroindene
CID 145156021
[1-(methylamino)-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 61054317
[1-[2-(diethylamino)ethylamino]-2,3-dihydroinden-1-yl]methanol
CID 61049623
1-(propylamino)-2,3-dihydroindene-1-carboxamide
CID 60796921
(1-propan-2-yl-2,3-dihydroinden-1-yl)methanol
CID 146230442
2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol
CID 102025626
[(1S)-1-amino-2,3-dihydroinden-1-yl]methanol
CID 51892318
1-(propylaminomethyl)-2,3-dihydroinden-1-ol
CID 62772754

Frequently Asked Questions

What is the IUPAC name of 2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol?
The IUPAC name of 2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol (CID 130905101) is 2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol.
What is the SMILES notation for 2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol?
The canonical SMILES for 2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol is CC1(NCCO)CCc2ccccc21.
What is the InChIKey of 2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol?
The InChIKey is ZBSFDNSQAXVZNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-12(13-8-9-14)7-6-10-4-2-3-5-11(10)12/h2-5,13-14H,6-9H2,1H3.
What are the key properties of 2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol?
2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol has a molecular weight of 191.27 g/mol, XLogP of 1.43, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methyl-2,3-dihydroinden-1-yl)amino]ethanol is sourced from PubChem (CID 130905101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).