8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline

C11H10N2 — CID 59469591

IUPAC8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline
SMILESc1cc2ccc3c(c2cn1)CCN3
InChIInChI=1S/C11H10N2/c1-2-11-9(4-6-13-11)10-7-12-5-3-8(1)10/h1-3,5,7,13H,4,6H2
InChIKeyHCHHDCSBBGQWAA-UHFFFAOYSA-N
MW170.22 g/mol
LogP2.20
Rot. Bonds

About 8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline

8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline (PubChem CID 59469591) has the molecular formula C11H10N2 and a molecular weight of 170.22 g/mol. Its IUPAC name is 8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline.

Molecular Properties

Compound Name8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline
PubChem CID59469591
Molecular FormulaC11H10N2
Molecular Weight170.22 g/mol
Exact Mass170.08
IUPAC Name8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline
SMILESc1cc2ccc3c(c2cn1)CCN3
InChIInChI=1S/C11H10N2/c1-2-11-9(4-6-13-11)10-7-12-5-3-8(1)10/h1-3,5,7,13H,4,6H2
InChIKeyHCHHDCSBBGQWAA-UHFFFAOYSA-N
XLogP2.20
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.22
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,9-phenanthroline
CID 23271029
1H-pyrazolo[4,5-h]isoquinoline
CID 70533280
8,44-diazadodecacyclo[24.24.0.02,23.03,20.04,17.05,14.06,11.029,50.032,49.035,48.038,47.041,46]pentaconta-1(26),2(23),3(20),4(17),5(14),6(11),7,9,12,15,18,21,24,27,29(50),30,32(49),33,35(48),36,38(47),39,41(46),42,44-pentacosaene
CID 122389532
pyrido[3,4-f]phthalazine
CID 122577314
pyrido[4,3-h]quinazoline
CID 118895264
1H-pyrrolo[3,2-h]isoquinoline
CID 22622222
5-chloro-4-fluoro-2,3-dihydro-1H-indole;hydrochloride
CID 135392566
7H-pyrrolo[2,3-h]isoquinoline
CID 86733878
1,2,3,4-tetrahydropyrido[4,3-c]pyridazine
CID 91080089
6,7,8,9-tetrahydro-[1,2]oxazolo[4,5-f]quinoline
CID 176741794
8-piperazin-1-ylisoquinoline
CID 21070960
3,8-phenanthroline
CID 13064691

Frequently Asked Questions

What is the IUPAC name of 8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline?
The IUPAC name of 8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline (CID 59469591) is 8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline.
What is the SMILES notation for 8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline?
The canonical SMILES for 8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline is c1cc2ccc3c(c2cn1)CCN3.
What is the InChIKey of 8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline?
The InChIKey is HCHHDCSBBGQWAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2/c1-2-11-9(4-6-13-11)10-7-12-5-3-8(1)10/h1-3,5,7,13H,4,6H2.
What are the key properties of 8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline?
8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline has a molecular weight of 170.22 g/mol, XLogP of 2.20, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,9-dihydro-7H-pyrrolo[2,3-h]isoquinoline is sourced from PubChem (CID 59469591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).