6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one

C81H89Cl6N23O6 — CID 159463402

IUPAC6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one
SMILESCC(C)CN1CCC(Cn2c(=O)[nH]c3ncc(Cl)cc32)C1.CC(C)N1CCC(n2c(=O)[nH]c3ncc(Cl)cc32)CC1.CC(c1cccnc1)n1c(=O)[nH]c2ncc(Cl)cc21.CC(c1ccncc1)n1c(=O)[nH]c2ncc(Cl)cc21.O=c1[nH]c2ncc(Cl)cc2n1CC1CCCCC1.O=c1[nH]c2ncc(Cl)cc2n1CCc1ccccn1
InChIInChI=1S/C15H21ClN4O.C14H19ClN4O.3C13H11ClN4O.C13H16ClN3O/c1-10(2)7-19-4-3-11(8-19)9-20-13-5-12(16)6-17-14(13)18-15(20)21;1-9(2)18-5-3-11(4-6-18)19-12-7-10(15)8-16-13(12)17-14(19)20;1-8(9-2-4-15-5-3-9)18-11-6-10(14)7-16-12(11)17-13(18)19;1-8(9-3-2-4-15-6-9)18-11-5-10(14)7-16-12(11)17-13(18)19;14-9-7-11-12(16-8-9)17-13(19)18(11)6-4-10-3-1-2-5-15-10;14-10-6-11-12(15-7-10)16-13(18)17(11)8-9-4-2-1-3-5-9/h5-6,10-11H,3-4,7-9H2,1-2H3,(H,17,18,21);7-9,11H,3-6H2,1-2H3,(H,16,17,20);2*2-8H,1H3,(H,16,17,19);1-3,5,7-8H,4,6H2,(H,16,17,19);6-7,9H,1-5,8H2,(H,15,16,18)
InChIKeyLUWIZYFFVSTFNI-UHFFFAOYSA-N
MW1693.48 g/mol
LogP14.52
Rot. Bonds15

About 6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one

6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one (PubChem CID 159463402) has the molecular formula C81H89Cl6N23O6 and a molecular weight of 1693.48 g/mol. Its IUPAC name is 6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one
PubChem CID159463402
Molecular FormulaC81H89Cl6N23O6
Molecular Weight1693.48 g/mol
Exact Mass1689.55
IUPAC Name6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one
SMILESCC(C)CN1CCC(Cn2c(=O)[nH]c3ncc(Cl)cc32)C1.CC(C)N1CCC(n2c(=O)[nH]c3ncc(Cl)cc32)CC1.CC(c1cccnc1)n1c(=O)[nH]c2ncc(Cl)cc21.CC(c1ccncc1)n1c(=O)[nH]c2ncc(Cl)cc21.O=c1[nH]c2ncc(Cl)cc2n1CC1CCCCC1.O=c1[nH]c2ncc(Cl)cc2n1CCc1ccccn1
InChIInChI=1S/C15H21ClN4O.C14H19ClN4O.3C13H11ClN4O.C13H16ClN3O/c1-10(2)7-19-4-3-11(8-19)9-20-13-5-12(16)6-17-14(13)18-15(20)21;1-9(2)18-5-3-11(4-6-18)19-12-7-10(15)8-16-13(12)17-14(19)20;1-8(9-2-4-15-5-3-9)18-11-6-10(14)7-16-12(11)17-13(18)19;1-8(9-3-2-4-15-6-9)18-11-5-10(14)7-16-12(11)17-13(18)19;14-9-7-11-12(16-8-9)17-13(19)18(11)6-4-10-3-1-2-5-15-10;14-10-6-11-12(15-7-10)16-13(18)17(11)8-9-4-2-1-3-5-9/h5-6,10-11H,3-4,7-9H2,1-2H3,(H,17,18,21);7-9,11H,3-6H2,1-2H3,(H,16,17,20);2*2-8H,1H3,(H,16,17,19);1-3,5,7-8H,4,6H2,(H,16,17,19);6-7,9H,1-5,8H2,(H,15,16,18)
InChIKeyLUWIZYFFVSTFNI-UHFFFAOYSA-N
XLogP14.52
TPSA349.23 Ų
H-Bond Donors6
H-Bond Acceptors23
Rotatable Bonds15
Heavy Atoms116
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001693.48
LogP ≤ 514.52
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1023

Analyze 6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one (CID 159463402) is 6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one is CC(C)CN1CCC(Cn2c(=O)[nH]c3ncc(Cl)cc32)C1.CC(C)N1CCC(n2c(=O)[nH]c3ncc(Cl)cc32)CC1.CC(c1cccnc1)n1c(=O)[nH]c2ncc(Cl)cc21.CC(c1ccncc1)n1c(=O)[nH]c2ncc(Cl)cc21.O=c1[nH]c2ncc(Cl)cc2n1CC1CCCCC1.O=c1[nH]c2ncc(Cl)cc2n1CCc1ccccn1.
What is the InChIKey of 6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is LUWIZYFFVSTFNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN4O.C14H19ClN4O.3C13H11ClN4O.C13H16ClN3O/c1-10(2)7-19-4-3-11(8-19)9-20-13-5-12(16)6-17-14(13)18-15(20)21;1-9(2)18-5-3-11(4-6-18)19-12-7-10(15)8-16-13(12)17-14(19)20;1-8(9-2-4-15-5-3-9)18-11-6-10(14)7-16-12(11)17-13(18)19;1-8(9-3-2-4-15-6-9)18-11-5-10(14)7-16-12(11)17-13(18)19;14-9-7-11-12(16-8-9)17-13(19)18(11)6-4-10-3-1-2-5-15-10;14-10-6-11-12(15-7-10)16-13(18)17(11)8-9-4-2-1-3-5-9/h5-6,10-11H,3-4,7-9H2,1-2H3,(H,17,18,21);7-9,11H,3-6H2,1-2H3,(H,16,17,20);2*2-8H,1H3,(H,16,17,19);1-3,5,7-8H,4,6H2,(H,16,17,19);6-7,9H,1-5,8H2,(H,15,16,18).
What are the key properties of 6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one?
6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 1693.48 g/mol, XLogP of 14.52, 15 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-1-(cyclohexylmethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-propan-2-ylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-3-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-1-(2-pyridin-2-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 159463402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).