1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide

C20H18N6O — CID 121249860

IUPAC1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide
SMILESCn1cc(-c2nc3nccc(-c4ccc(C5(C(N)=O)CC5)cc4)c3[nH]2)cn1
InChIInChI=1S/C20H18N6O/c1-26-11-13(10-23-26)17-24-16-15(6-9-22-18(16)25-17)12-2-4-14(5-3-12)20(7-8-20)19(21)27/h2-6,9-11H,7-8H2,1H3,(H2,21,27)(H,22,24,25)
InChIKeyPILKKQJKGMGJQL-UHFFFAOYSA-N
MW358.41 g/mol
LogP2.54
Rot. Bonds4

About 1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide

1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide (PubChem CID 121249860) has the molecular formula C20H18N6O and a molecular weight of 358.41 g/mol. Its IUPAC name is 1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide
PubChem CID121249860
Molecular FormulaC20H18N6O
Molecular Weight358.41 g/mol
Exact Mass358.15
IUPAC Name1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide
SMILESCn1cc(-c2nc3nccc(-c4ccc(C5(C(N)=O)CC5)cc4)c3[nH]2)cn1
InChIInChI=1S/C20H18N6O/c1-26-11-13(10-23-26)17-24-16-15(6-9-22-18(16)25-17)12-2-4-14(5-3-12)20(7-8-20)19(21)27/h2-6,9-11H,7-8H2,1H3,(H2,21,27)(H,22,24,25)
InChIKeyPILKKQJKGMGJQL-UHFFFAOYSA-N
XLogP2.54
TPSA102.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.41
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-fluoro-4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclobutan-1-amine
CID 171803789
4-tert-butyl-N-[2-[2-fluoro-4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]propan-2-yl]benzamide
CID 121249938
5-tert-butyl-N-[[2-fluoro-4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]methyl]-1,3,4-oxadiazole-2-carboxamide
CID 121249712
5-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]-1,4-dihydro-3,1-benzoxazin-2-one
CID 121249944
N-[[2-fluoro-4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]methyl]-6-methyl-2-azaspiro[3.3]heptane-2-carboxamide
CID 121249705
2-[5-(1-methylpyrazol-4-yl)-1H-indazol-3-yl]-7-pyridin-4-yl-1H-imidazo[4,5-b]pyridine
CID 136937864
3-[(2-methylpropan-2-yl)oxy]-N-[(1S)-6-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]azetidine-1-carboxamide
CID 172731006
5-fluoro-N-[[2-fluoro-4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]methyl]-2-methoxybenzamide
CID 171803712
3-[2-fluoro-4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]-1-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propan-1-one
CID 159724382
1-[5-[2-[5-(1-methylpyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-b]pyridin-7-yl]thiophen-2-yl]ethanone
CID 136937780
1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-3-[2-fluoro-4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]propan-1-one
CID 149130542
3-tert-butyl-N-[[2-fluoro-4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]methyl]-1,2,4-oxadiazole-5-carboxamide
CID 121249896

Frequently Asked Questions

What is the IUPAC name of 1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide (CID 121249860) is 1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide is Cn1cc(-c2nc3nccc(-c4ccc(C5(C(N)=O)CC5)cc4)c3[nH]2)cn1.
What is the InChIKey of 1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide?
The InChIKey is PILKKQJKGMGJQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N6O/c1-26-11-13(10-23-26)17-24-16-15(6-9-22-18(16)25-17)12-2-4-14(5-3-12)20(7-8-20)19(21)27/h2-6,9-11H,7-8H2,1H3,(H2,21,27)(H,22,24,25).
What are the key properties of 1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide?
1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide has a molecular weight of 358.41 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 121249860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).