8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole

C15H14N2 — CID 162624761

IUPAC8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole
SMILESCc1ccc2c(n1)[nH]c1c(C3CC3)cccc12
InChIInChI=1S/C15H14N2/c1-9-5-8-13-12-4-2-3-11(10-6-7-10)14(12)17-15(13)16-9/h2-5,8,10H,6-7H2,1H3,(H,16,17)
InChIKeyQMVQHFCXSBAHPD-UHFFFAOYSA-N
MW222.29 g/mol
LogP3.90
Rot. Bonds1

About 8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole

8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole (PubChem CID 162624761) has the molecular formula C15H14N2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole.

Molecular Properties

Compound Name8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole
PubChem CID162624761
Molecular FormulaC15H14N2
Molecular Weight222.29 g/mol
Exact Mass222.12
IUPAC Name8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole
SMILESCc1ccc2c(n1)[nH]c1c(C3CC3)cccc12
InChIInChI=1S/C15H14N2/c1-9-5-8-13-12-4-2-3-11(10-6-7-10)14(12)17-15(13)16-9/h2-5,8,10H,6-7H2,1H3,(H,16,17)
InChIKeyQMVQHFCXSBAHPD-UHFFFAOYSA-N
XLogP3.90
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Amino-9H-pyrido(2,3-b)indole
CID 62805
3-Amino-1,4-dimethyl-5H-pyrido(4,3-b)indole
CID 5284474
3-Amino-1-methyl-5H-pyrido(4,3-b)indole
CID 5284476
2-Amino-3-methyl-9H-pyrido(2,3-b)indole
CID 62244
6H-Indolo(2,3-b)quinoxaline
CID 5356192
5,7-diphenyl-2-propan-2-yl-1H-imidazo[4,5-b]pyridine
CID 16109428
2,6-Diphenyl-8-(1-ethylpropyl)-1-deazapurine
CID 16109429
2-cyclopentyl-5,7-diphenyl-1H-imidazo[4,5-b]pyridine
CID 16109430
2-cyclohexyl-5,7-di(phenyl)-1H-imidazo[4,5-b]pyridine
CID 16109435
2-(2-methylpropyl)-5,7-diphenyl-1H-imidazo[4,5-b]pyridine
CID 44418996
2,6-Dimethyl-8-ethyl-1-deazapurine
CID 9815374
6H-indolo(2,3-b)quinoline
CID 67484

Frequently Asked Questions

What is the IUPAC name of 8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole?
The IUPAC name of 8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole (CID 162624761) is 8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole.
What is the SMILES notation for 8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole?
The canonical SMILES for 8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole is Cc1ccc2c(n1)[nH]c1c(C3CC3)cccc12.
What is the InChIKey of 8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole?
The InChIKey is QMVQHFCXSBAHPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2/c1-9-5-8-13-12-4-2-3-11(10-6-7-10)14(12)17-15(13)16-9/h2-5,8,10H,6-7H2,1H3,(H,16,17).
What are the key properties of 8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole?
8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole has a molecular weight of 222.29 g/mol, XLogP of 3.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclopropyl-2-methyl-9H-pyrido[2,3-b]indole is sourced from PubChem (CID 162624761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).