6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine

C98H131N23 — CID 159212472

IUPAC6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine
SMILESC1=c2cccnc2=CC1.C1=c2ccncc2=CC1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.c1cc2[nH]ccc2cn1.c1cc2cc[nH]c2cn1.c1cc2cnccn2c1.c1cnc2[nH]ccc2c1.c1cnc2cc[nH]c2c1.c1cnc2cccn2c1.c1cnc2cncn2c1.c1cnc2nc[nH]c2c1.c1cnc2nccn2c1
InChIInChI=1S/2C8H7N.6C7H6N2.3C6H5N3.11C2H6/c1-3-7-4-2-6-9-8(7)5-1;1-2-7-4-5-9-6-8(7)3-1;1-4-9-7-2-3-8-5-6(1)7;1-3-8-5-7-6(1)2-4-9-7;1-3-7-8-4-2-6-9(7)5-1;1-2-7-6-8-3-5-9(7)4-1;1-2-6-7(8-4-1)3-5-9-6;1-2-6-3-5-9-7(6)8-4-1;1-2-7-6-8-3-5-9(6)4-1;1-2-8-6-4-7-5-9(6)3-1;1-2-5-6(7-3-1)9-4-8-5;11*1-2/h2*2-6H,1H2;2*1-5,9H;2*1-6H;1-5,9H;1-5H,(H,8,9);2*1-5H;1-4H,(H,7,8,9);11*1-2H3
InChIKeyKQQXYMIPCSOIPN-UHFFFAOYSA-N
MW1631.29 g/mol
LogP22.72
Rot. Bonds

About 6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine

6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine (PubChem CID 159212472) has the molecular formula C98H131N23 and a molecular weight of 1631.29 g/mol. Its IUPAC name is 6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine.

Molecular Properties

Compound Name6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine
PubChem CID159212472
Molecular FormulaC98H131N23
Molecular Weight1631.29 g/mol
Exact Mass1630.10
IUPAC Name6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine
SMILESC1=c2cccnc2=CC1.C1=c2ccncc2=CC1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.c1cc2[nH]ccc2cn1.c1cc2cc[nH]c2cn1.c1cc2cnccn2c1.c1cnc2[nH]ccc2c1.c1cnc2cc[nH]c2c1.c1cnc2cccn2c1.c1cnc2cncn2c1.c1cnc2nc[nH]c2c1.c1cnc2nccn2c1
InChIInChI=1S/2C8H7N.6C7H6N2.3C6H5N3.11C2H6/c1-3-7-4-2-6-9-8(7)5-1;1-2-7-4-5-9-6-8(7)3-1;1-4-9-7-2-3-8-5-6(1)7;1-3-8-5-7-6(1)2-4-9-7;1-3-7-8-4-2-6-9(7)5-1;1-2-7-6-8-3-5-9(7)4-1;1-2-6-7(8-4-1)3-5-9-6;1-2-6-3-5-9-7(6)8-4-1;1-2-7-6-8-3-5-9(6)4-1;1-2-8-6-4-7-5-9(6)3-1;1-2-5-6(7-3-1)9-4-8-5;11*1-2/h2*2-6H,1H2;2*1-5,9H;2*1-6H;1-5,9H;1-5H,(H,8,9);2*1-5H;1-4H,(H,7,8,9);11*1-2H3
InChIKeyKQQXYMIPCSOIPN-UHFFFAOYSA-N
XLogP22.72
TPSA277.05 Ų
H-Bond Donors5
H-Bond Acceptors18
Rotatable Bonds
Heavy Atoms121
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001631.29
LogP ≤ 522.72
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1018

Analyze 6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine?
The IUPAC name of 6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine (CID 159212472) is 6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine.
What is the SMILES notation for 6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine?
The canonical SMILES for 6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine is C1=c2cccnc2=CC1.C1=c2ccncc2=CC1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.c1cc2[nH]ccc2cn1.c1cc2cc[nH]c2cn1.c1cc2cnccn2c1.c1cnc2[nH]ccc2c1.c1cnc2cc[nH]c2c1.c1cnc2cccn2c1.c1cnc2cncn2c1.c1cnc2nc[nH]c2c1.c1cnc2nccn2c1.
What is the InChIKey of 6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine?
The InChIKey is KQQXYMIPCSOIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H7N.6C7H6N2.3C6H5N3.11C2H6/c1-3-7-4-2-6-9-8(7)5-1;1-2-7-4-5-9-6-8(7)3-1;1-4-9-7-2-3-8-5-6(1)7;1-3-8-5-7-6(1)2-4-9-7;1-3-7-8-4-2-6-9(7)5-1;1-2-7-6-8-3-5-9(7)4-1;1-2-6-7(8-4-1)3-5-9-6;1-2-6-3-5-9-7(6)8-4-1;1-2-7-6-8-3-5-9(6)4-1;1-2-8-6-4-7-5-9(6)3-1;1-2-5-6(7-3-1)9-4-8-5;11*1-2/h2*2-6H,1H2;2*1-5,9H;2*1-6H;1-5,9H;1-5H,(H,8,9);2*1-5H;1-4H,(H,7,8,9);11*1-2H3.
What are the key properties of 6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine?
6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine has a molecular weight of 1631.29 g/mol, XLogP of 22.72, 0 rotatable bonds, 5 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 6H-cyclopenta[b]pyridine;6H-cyclopenta[c]pyridine;ethane;imidazo[1,2-a]pyrimidine;imidazo[1,5-a]pyrimidine;1H-imidazo[4,5-b]pyridine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine is sourced from PubChem (CID 159212472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).