2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine

C83H101N25 — CID 157202966

IUPAC2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCC(C)c1ccc2cnnn2c1.CC(C)c1cccn2ncnc12.CC(C)c1ccn2ccnc2c1.CC(C)c1ccn2ncnc2c1.CC(C)c1ccn2nncc2c1.CC(C)c1ncc2[nH]ccc2n1.CC(C)c1ncc2c(n1)CC=C2.CC(C)c1ncnc2[nH]ccc12.CC(C)c1ncnn2cccc12
InChIInChI=1S/2C10H12N2.7C9H11N3/c1-8(2)9-3-5-12-6-4-11-10(12)7-9;1-7(2)10-11-6-8-4-3-5-9(8)12-10;1-7(2)8-3-4-9-5-10-11-12(9)6-8;1-7(2)8-3-4-12-9(5-8)10-6-11-12;1-7(2)8-3-4-12-9(5-8)6-10-11-12;1-6(2)8-7-3-4-10-9(7)12-5-11-8;1-6(2)9-11-5-8-7(12-9)3-4-10-8;1-7(2)9-8-4-3-5-12(8)11-6-10-9;1-7(2)8-4-3-5-12-9(8)10-6-11-12/h3-8H,1-2H3;3-4,6-7H,5H2,1-2H3;3*3-7H,1-2H3;3-6H,1-2H3,(H,10,11,12);3-6,10H,1-2H3;2*3-7H,1-2H3
InChIKeyARABXXGSCHKHEF-UHFFFAOYSA-N
MW1448.90 g/mol
LogP18.05
Rot. Bonds9

About 2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine

2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 157202966) has the molecular formula C83H101N25 and a molecular weight of 1448.90 g/mol. Its IUPAC name is 2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID157202966
Molecular FormulaC83H101N25
Molecular Weight1448.90 g/mol
Exact Mass1447.87
IUPAC Name2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCC(C)c1ccc2cnnn2c1.CC(C)c1cccn2ncnc12.CC(C)c1ccn2ccnc2c1.CC(C)c1ccn2ncnc2c1.CC(C)c1ccn2nncc2c1.CC(C)c1ncc2[nH]ccc2n1.CC(C)c1ncc2c(n1)CC=C2.CC(C)c1ncnc2[nH]ccc12.CC(C)c1ncnn2cccc12
InChIInChI=1S/2C10H12N2.7C9H11N3/c1-8(2)9-3-5-12-6-4-11-10(12)7-9;1-7(2)10-11-6-8-4-3-5-9(8)12-10;1-7(2)8-3-4-9-5-10-11-12(9)6-8;1-7(2)8-3-4-12-9(5-8)10-6-11-12;1-7(2)8-3-4-12-9(5-8)6-10-11-12;1-6(2)8-7-3-4-10-9(7)12-5-11-8;1-6(2)9-11-5-8-7(12-9)3-4-10-8;1-7(2)9-8-4-3-5-12(8)11-6-10-9;1-7(2)8-4-3-5-12-9(8)10-6-11-12/h3-8H,1-2H3;3-4,6-7H,5H2,1-2H3;3*3-7H,1-2H3;3-6H,1-2H3,(H,10,11,12);3-6,10H,1-2H3;2*3-7H,1-2H3
InChIKeyARABXXGSCHKHEF-UHFFFAOYSA-N
XLogP18.05
TPSA277.17 Ų
H-Bond Donors2
H-Bond Acceptors23
Rotatable Bonds9
Heavy Atoms108
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001448.90
LogP ≤ 518.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1023

Analyze 2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine with MolForge

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Related Compounds

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CID 73777037
4-(1-Methylpyrazol-4-yl)-12-[4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 58266791
Ipivivint
CID 136213660
[(1S,5R)-3-[10-[6-(1H-imidazol-2-yl)-3-pyridinyl]-1,3,8,12-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaen-7-yl]-8-azabicyclo[3.2.1]octan-8-yl]-(1H-1,2,4-triazol-5-yl)methanone
CID 136259916
3-[1-[[4-[3-amino-1-[2-(1H-imidazol-5-yl)ethyl]-5-phenylpyrazolo[3,4-b]pyridin-6-yl]phenyl]methyl]piperidin-4-yl]-1H-benzimidazol-2-one
CID 11296432
3-methyl-9-phenyl-8-(4-((4-(5-(pyridin-2-yl)-1H-1,2,4-triazol-3-yl)piperidin-1-yl)methyl)phenyl)-[1,2,4]triazolo[3,4-f][1,6]naphthyridine
CID 15979148
9-phenyl-8-(4-((4-(4-(pyridin-2-yl)-1H-imidazol-1-yl)piperidin-1-yl)methyl)phenyl)-[1,2,4]triazolo[3,4-f][1,6]naphthyridin-3-amine
CID 15979150
1,2,4-Triazolo[3,4-f][1,6]naphthyridine, 9-phenyl-8-[4-[[4-[5-(2-pyridinyl)-1H-1,2,4-triazol-3-yl]-1-piperidinyl]methyl]phenyl]-
CID 15979276
6-(1-methylpyrazol-4-yl)-3-[(1S)-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 24871821
6-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine
CID 44448973
12-[4-(Piperidin-1-ylmethyl)phenyl]-4-pyridazin-4-yl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 44546490
3-((4-methylpiperazin-1-yl)methyl)-9-phenyl-8-(4-((4-(5-(pyridin-2-yl)-1H-1,2,4-triazol-3-yl)piperidin-1-yl)methyl)phenyl)-[1,2,4]triazolo[3,4-f][1,6]naphthyridine
CID 44572054

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine (CID 157202966) is 2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine is CC(C)c1ccc2cnnn2c1.CC(C)c1cccn2ncnc12.CC(C)c1ccn2ccnc2c1.CC(C)c1ccn2ncnc2c1.CC(C)c1ccn2nncc2c1.CC(C)c1ncc2[nH]ccc2n1.CC(C)c1ncc2c(n1)CC=C2.CC(C)c1ncnc2[nH]ccc12.CC(C)c1ncnn2cccc12.
What is the InChIKey of 2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is ARABXXGSCHKHEF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H12N2.7C9H11N3/c1-8(2)9-3-5-12-6-4-11-10(12)7-9;1-7(2)10-11-6-8-4-3-5-9(8)12-10;1-7(2)8-3-4-9-5-10-11-12(9)6-8;1-7(2)8-3-4-12-9(5-8)10-6-11-12;1-7(2)8-3-4-12-9(5-8)6-10-11-12;1-6(2)8-7-3-4-10-9(7)12-5-11-8;1-6(2)9-11-5-8-7(12-9)3-4-10-8;1-7(2)9-8-4-3-5-12(8)11-6-10-9;1-7(2)8-4-3-5-12-9(8)10-6-11-12/h3-8H,1-2H3;3-4,6-7H,5H2,1-2H3;3*3-7H,1-2H3;3-6H,1-2H3,(H,10,11,12);3-6,10H,1-2H3;2*3-7H,1-2H3.
What are the key properties of 2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine?
2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 1448.90 g/mol, XLogP of 18.05, 9 rotatable bonds, 2 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-7H-cyclopenta[d]pyrimidine;7-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-propan-2-yltriazolo[1,5-a]pyridine;6-propan-2-yltriazolo[1,5-a]pyridine;7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 157202966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).