2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine

C17H13N3 — CID 102120647

IUPAC2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine
SMILESCc1ccnc(-c2ccc3c(n2)-c2ccccc2C3)n1
InChIInChI=1S/C17H13N3/c1-11-8-9-18-17(19-11)15-7-6-13-10-12-4-2-3-5-14(12)16(13)20-15/h2-9H,10H2,1H3
InChIKeyQOUGZKZKGGVDNV-UHFFFAOYSA-N
MW259.31 g/mol
LogP3.42
Rot. Bonds1

About 2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine

2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine (PubChem CID 102120647) has the molecular formula C17H13N3 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine.

Molecular Properties

Compound Name2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine
PubChem CID102120647
Molecular FormulaC17H13N3
Molecular Weight259.31 g/mol
Exact Mass259.11
IUPAC Name2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine
SMILESCc1ccnc(-c2ccc3c(n2)-c2ccccc2C3)n1
InChIInChI=1S/C17H13N3/c1-11-8-9-18-17(19-11)15-7-6-13-10-12-4-2-3-5-14(12)16(13)20-15/h2-9H,10H2,1H3
InChIKeyQOUGZKZKGGVDNV-UHFFFAOYSA-N
XLogP3.42
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyridin-2-yl-5H-indeno[1,2-b]pyridine
CID 58637338
4-methyl-2-[5-methyl-6-(4-methylphenyl)-2-pyridinyl]pyrimidine
CID 14281096
4-methyl-2-[6-[2-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-pyridinyl]pyrimidine
CID 14796154
2-(2-bromophenyl)-4-methylpyrimidine
CID 21025834
2,20-diazapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,16(21),17,19-nonaene
CID 14812683
2-(6-butyl-2-pyridinyl)-4-methylpyrimidine
CID 14253092
5H-indeno[1,2-b]pyridine;indeno[1,2-b]pyridin-5-one
CID 160581991
4-chloro-2-methyl-5H-indeno[1,2-b]pyridine
CID 10512877
2-[6-(2-chlorophenoxy)-5-methyl-2-pyridinyl]-4-methylpyrimidine
CID 14458723
4-methyl-2-[6-(4-propan-2-ylphenoxy)-2-pyridinyl]pyrimidine
CID 14458745
4-methyl-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]pyrimidine
CID 19780240
2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine
CID 90142068

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine?
The IUPAC name of 2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine (CID 102120647) is 2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine.
What is the SMILES notation for 2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine?
The canonical SMILES for 2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine is Cc1ccnc(-c2ccc3c(n2)-c2ccccc2C3)n1.
What is the InChIKey of 2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine?
The InChIKey is QOUGZKZKGGVDNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3/c1-11-8-9-18-17(19-11)15-7-6-13-10-12-4-2-3-5-14(12)16(13)20-15/h2-9H,10H2,1H3.
What are the key properties of 2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine?
2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine has a molecular weight of 259.31 g/mol, XLogP of 3.42, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpyrimidin-2-yl)-5H-indeno[1,2-b]pyridine is sourced from PubChem (CID 102120647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).