10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol

C10H7NO — CID 174364509

IUPAC10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol
SMILESOc1c2cc([nH]2)c2ccccc12
InChIInChI=1S/C10H7NO/c12-10-7-4-2-1-3-6(7)8-5-9(10)11-8/h1-5,11-12H
InChIKeyBHKPIONEGKMKBU-UHFFFAOYSA-N
MW157.17 g/mol
LogP2.46
Rot. Bonds

About 10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol

10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol (PubChem CID 174364509) has the molecular formula C10H7NO and a molecular weight of 157.17 g/mol. Its IUPAC name is 10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol.

Molecular Properties

Compound Name10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol
PubChem CID174364509
Molecular FormulaC10H7NO
Molecular Weight157.17 g/mol
Exact Mass157.05
IUPAC Name10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol
SMILESOc1c2cc([nH]2)c2ccccc12
InChIInChI=1S/C10H7NO/c12-10-7-4-2-1-3-6(7)8-5-9(10)11-8/h1-5,11-12H
InChIKeyBHKPIONEGKMKBU-UHFFFAOYSA-N
XLogP2.46
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.17
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol with MolForge

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Related Compounds

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CID 58471811
CID 70460275
CID 70460275
9H-carbazole
CID 66668984
9H-carbazole;copper
CID 159878189
bis(9H-carbazole);platinum(2+)
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bis(9H-carbazole);ethane
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9H-carbazole;ethane
CID 91098062
37,38,39,40-tetrazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1(37),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,29,31,33,35-nonadecaene
CID 135437216
9H-carbazole;carbonic acid
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CID 131863122
CID 131863122
2,16-dioxa-12,26-diazaheptacyclo[15.11.0.03,15.05,13.06,11.019,27.020,25]octacosa-1(17),3(15),4,6,8,10,13,18,20,22,24,27-dodecaene
CID 126567892
11,20-diazaheptacyclo[15.11.0.02,14.04,12.05,10.019,27.021,26]octacosa-1(28),2,4(12),5,7,9,13,15,17,19(27),21,23,25-tridecaene
CID 102495063

Frequently Asked Questions

What is the IUPAC name of 10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol?
The IUPAC name of 10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol (CID 174364509) is 10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol.
What is the SMILES notation for 10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol?
The canonical SMILES for 10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol is Oc1c2cc([nH]2)c2ccccc12.
What is the InChIKey of 10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol?
The InChIKey is BHKPIONEGKMKBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7NO/c12-10-7-4-2-1-3-6(7)8-5-9(10)11-8/h1-5,11-12H.
What are the key properties of 10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol?
10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol has a molecular weight of 157.17 g/mol, XLogP of 2.46, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-azatricyclo[7.1.1.02,7]undeca-1(11),2,4,6,8-pentaen-8-ol is sourced from PubChem (CID 174364509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).