2,5-dihydro-1H-pyrido[4,3-b]indole

C11H10N2 — CID 68923227

IUPAC2,5-dihydro-1H-pyrido[4,3-b]indole
SMILESC1=Cc2[nH]c3ccccc3c2CN1
InChIInChI=1S/C11H10N2/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-6,12-13H,7H2
InChIKeySHTPHYSDMOPHFK-UHFFFAOYSA-N
MW170.22 g/mol
LogP2.24
Rot. Bonds

About 2,5-dihydro-1H-pyrido[4,3-b]indole

2,5-dihydro-1H-pyrido[4,3-b]indole (PubChem CID 68923227) has the molecular formula C11H10N2 and a molecular weight of 170.22 g/mol. Its IUPAC name is 2,5-dihydro-1H-pyrido[4,3-b]indole.

Molecular Properties

Compound Name2,5-dihydro-1H-pyrido[4,3-b]indole
PubChem CID68923227
Molecular FormulaC11H10N2
Molecular Weight170.22 g/mol
Exact Mass170.08
IUPAC Name2,5-dihydro-1H-pyrido[4,3-b]indole
SMILESC1=Cc2[nH]c3ccccc3c2CN1
InChIInChI=1S/C11H10N2/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-6,12-13H,7H2
InChIKeySHTPHYSDMOPHFK-UHFFFAOYSA-N
XLogP2.24
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.22
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

8-methyl-2,5-dihydro-1H-pyrido[4,3-b]indole
CID 121381180
5,11-dimethyl-2,6-dihydro-1H-pyrido[4,3-b]carbazole
CID 67781733
3-bromo-4,9-dihydro-3H-carbazole
CID 66807686
3,3-bis(3-bromopropyl)-4,9-dihydrocarbazole
CID 174721399
8,18,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),19-nonaene
CID 118685180
10a,11-dihydro-5H-benzo[b]carbazole
CID 137386521
3,3-dibenzyl-4,9-dihydrocarbazole
CID 174416262
9H-carbazole
CID 66668984
1,2,3,4,5,10-hexahydro-[1,2,4]diazaphosphepino[5,6-b]indole
CID 146492364
1,2,3,5-tetrahydrocyclopenta[c]quinoline-4-thione
CID 686232
bis(9H-carbazole);platinum(2+)
CID 175826437
9H-carbazole;copper
CID 159878189

Frequently Asked Questions

What is the IUPAC name of 2,5-dihydro-1H-pyrido[4,3-b]indole?
The IUPAC name of 2,5-dihydro-1H-pyrido[4,3-b]indole (CID 68923227) is 2,5-dihydro-1H-pyrido[4,3-b]indole.
What is the SMILES notation for 2,5-dihydro-1H-pyrido[4,3-b]indole?
The canonical SMILES for 2,5-dihydro-1H-pyrido[4,3-b]indole is C1=Cc2[nH]c3ccccc3c2CN1.
What is the InChIKey of 2,5-dihydro-1H-pyrido[4,3-b]indole?
The InChIKey is SHTPHYSDMOPHFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-6,12-13H,7H2.
What are the key properties of 2,5-dihydro-1H-pyrido[4,3-b]indole?
2,5-dihydro-1H-pyrido[4,3-b]indole has a molecular weight of 170.22 g/mol, XLogP of 2.24, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydro-1H-pyrido[4,3-b]indole is sourced from PubChem (CID 68923227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).