(5R)-5H-benzo[7]annulen-5-amine

C11H11N — CID 101144448

IUPAC(5R)-5H-benzo[7]annulen-5-amine
SMILESN[C@@H]1C=CC=Cc2ccccc21
InChIInChI=1S/C11H11N/c12-11-8-4-2-6-9-5-1-3-7-10(9)11/h1-8,11H,12H2/t11-/m1/s1
InChIKeyURPZBGCIXNSSDK-LLVKDONJSA-N
MW157.22 g/mol
LogP2.27
Rot. Bonds

About (5R)-5H-benzo[7]annulen-5-amine

(5R)-5H-benzo[7]annulen-5-amine (PubChem CID 101144448) has the molecular formula C11H11N and a molecular weight of 157.22 g/mol. Its IUPAC name is (5R)-5H-benzo[7]annulen-5-amine.

Molecular Properties

Compound Name(5R)-5H-benzo[7]annulen-5-amine
PubChem CID101144448
Molecular FormulaC11H11N
Molecular Weight157.22 g/mol
Exact Mass157.09
IUPAC Name(5R)-5H-benzo[7]annulen-5-amine
SMILESN[C@@H]1C=CC=Cc2ccccc21
InChIInChI=1S/C11H11N/c12-11-8-4-2-6-9-5-1-3-7-10(9)11/h1-8,11H,12H2/t11-/m1/s1
InChIKeyURPZBGCIXNSSDK-LLVKDONJSA-N
XLogP2.27
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1H-inden-1-amine
CID 14298803
(1R,2R)-2-amino-1,2-dihydronaphthalen-1-ol;hydrochloride
CID 71310849
4H-thiochromen-4-amine
CID 22725329
hydron;1H-inden-1-ol
CID 174812636
2-(5H-benzo[7]annulen-5-yloxy)-2-oxoacetic acid
CID 67025356
(2R,5R,6Z,8Z)-tricyclo[8.4.0.02,5]tetradeca-1(14),6,8,10,12-pentaene-3,3,4,4-tetracarbonitrile
CID 90482300
1-(2-hydroxy-1,2-dihydronaphthalen-1-yl)-1,2-dihydronaphthalen-2-ol
CID 71289286
(1R,10R)-11-azatricyclo[8.2.2.02,7]tetradeca-2,4,6,8,13-pentaen-12-one
CID 98554052
6-diphenylsilylidenecyclohexa-2,4-dien-1-amine
CID 161182347
5-amino-5H-cyclohepta[b]pyran-2-one
CID 143196108
1-(7aH-inden-1-yl)-1H-indene
CID 173019299
1H-inden-1-ylmethanamine;hydrochloride
CID 67915005

Frequently Asked Questions

What is the IUPAC name of (5R)-5H-benzo[7]annulen-5-amine?
The IUPAC name of (5R)-5H-benzo[7]annulen-5-amine (CID 101144448) is (5R)-5H-benzo[7]annulen-5-amine.
What is the SMILES notation for (5R)-5H-benzo[7]annulen-5-amine?
The canonical SMILES for (5R)-5H-benzo[7]annulen-5-amine is N[C@@H]1C=CC=Cc2ccccc21.
What is the InChIKey of (5R)-5H-benzo[7]annulen-5-amine?
The InChIKey is URPZBGCIXNSSDK-LLVKDONJSA-N. The full InChI is InChI=1S/C11H11N/c12-11-8-4-2-6-9-5-1-3-7-10(9)11/h1-8,11H,12H2/t11-/m1/s1.
What are the key properties of (5R)-5H-benzo[7]annulen-5-amine?
(5R)-5H-benzo[7]annulen-5-amine has a molecular weight of 157.22 g/mol, XLogP of 2.27, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5H-benzo[7]annulen-5-amine is sourced from PubChem (CID 101144448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).