ethane;5H-pyrido[4,3-b]indole

C15H20N2 — CID 176987523

IUPACethane;5H-pyrido[4,3-b]indole
SMILESCC.CC.c1ccc2c(c1)[nH]c1ccncc12
InChIInChI=1S/C11H8N2.2C2H6/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10;2*1-2/h1-7,13H;2*1-2H3
InChIKeyDZFCEYUPMKEBEW-UHFFFAOYSA-N
MW228.34 g/mol
LogP4.77
Rot. Bonds

About ethane;5H-pyrido[4,3-b]indole

ethane;5H-pyrido[4,3-b]indole (PubChem CID 176987523) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is ethane;5H-pyrido[4,3-b]indole.

Molecular Properties

Compound Nameethane;5H-pyrido[4,3-b]indole
PubChem CID176987523
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Nameethane;5H-pyrido[4,3-b]indole
SMILESCC.CC.c1ccc2c(c1)[nH]c1ccncc12
InChIInChI=1S/C11H8N2.2C2H6/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10;2*1-2/h1-7,13H;2*1-2H3
InChIKeyDZFCEYUPMKEBEW-UHFFFAOYSA-N
XLogP4.77
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15,17,19-nonaene
CID 148886770
8,17-diazatricyclo[8.7.0.011,16]heptadeca-1(10),2,4,6,8,11,13,15-octaene
CID 151112967
9H-carbazole;ethane
CID 91098062
bis(9H-carbazole);ethane
CID 145072085
ethane;6H-pyrido[4,3-b]carbazole
CID 142896724
12-(9H-carbazol-3-yl)-4,8,11-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene
CID 144661360
9H-carbazole
CID 66668984
5-(9H-pyrido[2,3-b]indol-2-yl)-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 130353312
CID 158812485
CID 158812485
bromomethane;9H-carbazole
CID 67594562
9H-carbazole;copper
CID 159878189
bis(9H-carbazole);platinum(2+)
CID 175826437

Frequently Asked Questions

What is the IUPAC name of ethane;5H-pyrido[4,3-b]indole?
The IUPAC name of ethane;5H-pyrido[4,3-b]indole (CID 176987523) is ethane;5H-pyrido[4,3-b]indole.
What is the SMILES notation for ethane;5H-pyrido[4,3-b]indole?
The canonical SMILES for ethane;5H-pyrido[4,3-b]indole is CC.CC.c1ccc2c(c1)[nH]c1ccncc12.
What is the InChIKey of ethane;5H-pyrido[4,3-b]indole?
The InChIKey is DZFCEYUPMKEBEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2.2C2H6/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10;2*1-2/h1-7,13H;2*1-2H3.
What are the key properties of ethane;5H-pyrido[4,3-b]indole?
ethane;5H-pyrido[4,3-b]indole has a molecular weight of 228.34 g/mol, XLogP of 4.77, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5H-pyrido[4,3-b]indole is sourced from PubChem (CID 176987523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).