7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol

C11H14ClNO — CID 83835169

IUPAC7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCNC1CCc2ccc(Cl)cc2C1O
InChIInChI=1S/C11H14ClNO/c1-13-10-5-3-7-2-4-8(12)6-9(7)11(10)14/h2,4,6,10-11,13-14H,3,5H2,1H3
InChIKeyDGQKPSANFJQVDW-UHFFFAOYSA-N
MW211.69 g/mol
LogP1.91
Rot. Bonds1

About 7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol

7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 83835169) has the molecular formula C11H14ClNO and a molecular weight of 211.69 g/mol. Its IUPAC name is 7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID83835169
Molecular FormulaC11H14ClNO
Molecular Weight211.69 g/mol
Exact Mass211.08
IUPAC Name7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCNC1CCc2ccc(Cl)cc2C1O
InChIInChI=1S/C11H14ClNO/c1-13-10-5-3-7-2-4-8(12)6-9(7)11(10)14/h2,4,6,10-11,13-14H,3,5H2,1H3
InChIKeyDGQKPSANFJQVDW-UHFFFAOYSA-N
XLogP1.91
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.69
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[(1R,2R)-7-chloro-1-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]carbamic acid
CID 151448831
6-chloro-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 54776023
2-(6-chloro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
CID 105481539
6-chloro-2,3-dihydro-1H-inden-1-ol
CID 42614780
6-chloro-1-fluoro-2,3-dihydro-1H-indene
CID 84717388
[(1S,2R)-7-chloro-1-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl] carbamate
CID 134294881
6-chloro-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 61383375
(1S,2S)-2-(propan-2-ylamino)-1,2,3,4-tetrahydronaphthalene-1,7-diol
CID 96583640
[(1R)-6-chloro-2,3-dihydro-1H-inden-1-yl]hydrazine
CID 124537604
6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine
CID 115892348
6-chloro-N-cyclopentyl-2,3-dihydro-1H-inden-1-amine
CID 115867576
2-[(6-chloro-2,3-dihydro-1H-inden-1-yl)amino]-N-methylacetamide
CID 115867597

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol (CID 83835169) is 7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol is CNC1CCc2ccc(Cl)cc2C1O.
What is the InChIKey of 7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is DGQKPSANFJQVDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO/c1-13-10-5-3-7-2-4-8(12)6-9(7)11(10)14/h2,4,6,10-11,13-14H,3,5H2,1H3.
What are the key properties of 7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol?
7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 211.69 g/mol, XLogP of 1.91, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 83835169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).