(1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine

C11H14ClN — CID 130648464

IUPAC(1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCc1ccc2c(c1Cl)[C@@H](N)CCC2
InChIInChI=1S/C11H14ClN/c1-7-5-6-8-3-2-4-9(13)10(8)11(7)12/h5-6,9H,2-4,13H2,1H3/t9-/m0/s1
InChIKeyISYWLJAXQGWKRD-VIFPVBQESA-N
MW195.69 g/mol
LogP2.98
Rot. Bonds

About (1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine

(1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 130648464) has the molecular formula C11H14ClN and a molecular weight of 195.69 g/mol. Its IUPAC name is (1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name(1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID130648464
Molecular FormulaC11H14ClN
Molecular Weight195.69 g/mol
Exact Mass195.08
IUPAC Name(1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCc1ccc2c(c1Cl)[C@@H](N)CCC2
InChIInChI=1S/C11H14ClN/c1-7-5-6-8-3-2-4-9(13)10(8)11(7)12/h5-6,9H,2-4,13H2,1H3/t9-/m0/s1
InChIKeyISYWLJAXQGWKRD-VIFPVBQESA-N
XLogP2.98
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.69
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-6-chloro-8-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130624873
(1R)-6-methyl-2,3-dihydro-1H-indene-1,7-diamine
CID 130682325
(8S)-8-amino-1-methyl-5,6,7,8-tetrahydronaphthalene-2-carbonitrile
CID 131010416
(1R,8R)-1,2,3,6,7,8-hexahydro-as-indacene-1,8-diamine
CID 66733867
7-(3,4-dimethylphenyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 82542063
1,2,3,6,7,8-hexahydro-as-indacene-1,8-diamine
CID 77181867
(8R)-8-amino-5,6,7,8-tetrahydronaphthalen-1-ol
CID 130673743
(1S)-7-ethyl-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 130691961
(1S)-8-bromo-7-iodo-1,2,3,4-tetrahydronaphthalen-1-amine
CID 131151177
8-N,8-N-dimethyl-1,2,3,4-tetrahydronaphthalene-1,8-diamine
CID 112708810
(1R)-8-bromo-1,2,3,4-tetrahydronaphthalen-1-amine
CID 86328574
(5-amino-4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanol
CID 130044029

Frequently Asked Questions

What is the IUPAC name of (1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of (1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine (CID 130648464) is (1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for (1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for (1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine is Cc1ccc2c(c1Cl)[C@@H](N)CCC2.
What is the InChIKey of (1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is ISYWLJAXQGWKRD-VIFPVBQESA-N. The full InChI is InChI=1S/C11H14ClN/c1-7-5-6-8-3-2-4-9(13)10(8)11(7)12/h5-6,9H,2-4,13H2,1H3/t9-/m0/s1.
What are the key properties of (1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
(1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 195.69 g/mol, XLogP of 2.98, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 130648464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).