(6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile

C11H12N2 — CID 55294355

IUPAC(6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile
SMILESN#Cc1cccc2c1CC[C@@H](N)C2
InChIInChI=1S/C11H12N2/c12-7-9-3-1-2-8-6-10(13)4-5-11(8)9/h1-3,10H,4-6,13H2/t10-/m1/s1
InChIKeyYKQJQFKVUQTXFQ-SNVBAGLBSA-N
MW172.23 g/mol
LogP1.37
Rot. Bonds

About (6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile

(6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile (PubChem CID 55294355) has the molecular formula C11H12N2 and a molecular weight of 172.23 g/mol. Its IUPAC name is (6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile.

Molecular Properties

Compound Name(6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile
PubChem CID55294355
Molecular FormulaC11H12N2
Molecular Weight172.23 g/mol
Exact Mass172.10
IUPAC Name(6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile
SMILESN#Cc1cccc2c1CC[C@@H](N)C2
InChIInChI=1S/C11H12N2/c12-7-9-3-1-2-8-6-10(13)4-5-11(8)9/h1-3,10H,4-6,13H2/t10-/m1/s1
InChIKeyYKQJQFKVUQTXFQ-SNVBAGLBSA-N
XLogP1.37
TPSA49.81 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile?
The IUPAC name of (6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile (CID 55294355) is (6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile.
What is the SMILES notation for (6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile?
The canonical SMILES for (6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile is N#Cc1cccc2c1CC[C@@H](N)C2.
What is the InChIKey of (6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile?
The InChIKey is YKQJQFKVUQTXFQ-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H12N2/c12-7-9-3-1-2-8-6-10(13)4-5-11(8)9/h1-3,10H,4-6,13H2/t10-/m1/s1.
What are the key properties of (6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile?
(6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile has a molecular weight of 172.23 g/mol, XLogP of 1.37, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile is sourced from PubChem (CID 55294355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).