N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide

C20H21FN4O2 — CID 157140315

IUPACN-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide
SMILESCn1nc(OCC2CCCC2)c2ccc(NC(=O)c3ccc(F)cn3)cc21
InChIInChI=1S/C20H21FN4O2/c1-25-18-10-15(23-19(26)17-9-6-14(21)11-22-17)7-8-16(18)20(24-25)27-12-13-4-2-3-5-13/h6-11,13H,2-5,12H2,1H3,(H,23,26)
InChIKeyHLQAGCFRSLYQIZ-UHFFFAOYSA-N
MW368.41 g/mol
LogP3.93
Rot. Bonds5

About N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide

N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide (PubChem CID 157140315) has the molecular formula C20H21FN4O2 and a molecular weight of 368.41 g/mol. Its IUPAC name is N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide
PubChem CID157140315
Molecular FormulaC20H21FN4O2
Molecular Weight368.41 g/mol
Exact Mass368.16
IUPAC NameN-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide
SMILESCn1nc(OCC2CCCC2)c2ccc(NC(=O)c3ccc(F)cn3)cc21
InChIInChI=1S/C20H21FN4O2/c1-25-18-10-15(23-19(26)17-9-6-14(21)11-22-17)7-8-16(18)20(24-25)27-12-13-4-2-3-5-13/h6-11,13H,2-5,12H2,1H3,(H,23,26)
InChIKeyHLQAGCFRSLYQIZ-UHFFFAOYSA-N
XLogP3.93
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.41
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

US9951086, Example 68
CID 118173098
N-[1-(3-methoxyphenyl)-4,5,6,7-tetrahydroindazol-4-yl]pyridine-2-carboxamide
CID 50898239
US9951086, Example 46
CID 118172648
US9951086, Example 221
CID 118172833
US9951086, Example 71
CID 122637001
1,5-dimethyl-N-[3-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]oxy]phenyl]pyrazole-3-carboxamide
CID 22978008
US10435396, Example 23
CID 137377428
N-[4-[2-[2-(2,2-difluoroethoxy)-5,6,8,9-tetrahydropyrido[2,3-d]azepin-7-yl]ethyl]cyclohexyl]-2-methylindazole-4-carboxamide
CID 138670655
N-[4-[2-[2-(2,2-difluoropropoxy)-5,6,8,9-tetrahydropyrido[2,3-d]azepin-7-yl]ethyl]cyclohexyl]-2-methylindazole-4-carboxamide
CID 138671480
N-[4-[2-[2-(3,3-difluorocyclopentyl)oxy-5,6,8,9-tetrahydropyrido[2,3-d]azepin-7-yl]ethyl]cyclohexyl]-2-methylindazole-4-carboxamide
CID 155347405
N-[4-[2-[2-(2-fluoro-2-methylpropoxy)-5,6,8,9-tetrahydropyrido[2,3-d]azepin-7-yl]ethyl]cyclohexyl]-2-methylindazole-4-carboxamide
CID 155791912
(7R)-2-[(5-fluoro-2-pyridinyl)oxymethyl]-7-methyl-5-(2-methylphenyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 122190394

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide?
The IUPAC name of N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide (CID 157140315) is N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide.
What is the SMILES notation for N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide?
The canonical SMILES for N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide is Cn1nc(OCC2CCCC2)c2ccc(NC(=O)c3ccc(F)cn3)cc21.
What is the InChIKey of N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide?
The InChIKey is HLQAGCFRSLYQIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN4O2/c1-25-18-10-15(23-19(26)17-9-6-14(21)11-22-17)7-8-16(18)20(24-25)27-12-13-4-2-3-5-13/h6-11,13H,2-5,12H2,1H3,(H,23,26).
What are the key properties of N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide?
N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide has a molecular weight of 368.41 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-5-fluoropyridine-2-carboxamide is sourced from PubChem (CID 157140315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).