N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide

C20H20N6O2 — CID 90257047

IUPACN-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(-c2c[nH]c3ccc(-c4nnc(NC(C)C)o4)cc23)nc1
InChIInChI=1S/C20H20N6O2/c1-11(2)24-20-26-25-19(28-20)12-4-6-16-14(8-12)15(10-23-16)17-7-5-13(9-22-17)18(27)21-3/h4-11,23H,1-3H3,(H,21,27)(H,24,26)
InChIKeyGAXJBQGARSBXJQ-UHFFFAOYSA-N
MW376.42 g/mol
LogP3.46
Rot. Bonds5

About N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide

N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide (PubChem CID 90257047) has the molecular formula C20H20N6O2 and a molecular weight of 376.42 g/mol. Its IUPAC name is N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide
PubChem CID90257047
Molecular FormulaC20H20N6O2
Molecular Weight376.42 g/mol
Exact Mass376.16
IUPAC NameN-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(-c2c[nH]c3ccc(-c4nnc(NC(C)C)o4)cc23)nc1
InChIInChI=1S/C20H20N6O2/c1-11(2)24-20-26-25-19(28-20)12-4-6-16-14(8-12)15(10-23-16)17-7-5-13(9-22-17)18(27)21-3/h4-11,23H,1-3H3,(H,21,27)(H,24,26)
InChIKeyGAXJBQGARSBXJQ-UHFFFAOYSA-N
XLogP3.46
TPSA108.73 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 53.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-tert-butyl-5-[3-(4-cyclopropylpyrimidin-2-yl)-1H-indol-5-yl]-1,3,4-oxadiazol-2-amine
CID 66554898
N-[4-(propan-2-yl)phenyl]-5-{2-[2-(pyridin-4-yl)ethyl]pyridin-3-yl}-1,3,4-oxadiazol-2-amine
CID 15949471
N-(4-tert-butylphenyl)-5-{2-[2-(pyridin-4-yl)ethyl]pyridin-3-yl}-1,3,4-oxadiazol-2-amine
CID 23644872
N-(4-tert-butylphenyl)-5-{4-[2-(pyridin-4-yl)ethyl]pyridin-3-yl}-1,3,4-oxadiazol-2-amine
CID 23644875
N-(3-methylphenyl)-5-{2-[2-(pyridin-4-yl)ethyl]pyridin-3-yl}-1,3,4-oxadiazol-2-amine
CID 23644889
5-(1H-indol-5-yl)-3-(5-isopropyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
CID 77106364
3-(5-Cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)-2-pyridinamine
CID 77106960
2-(1H-indol-3-yl)-5-pyridin-4-yl-1,3,4-oxadiazole
CID 135908466
5-[3-(4-cyclopropylpyrimidin-2-yl)-1H-indol-5-yl]-N-propan-2-yl-1,3,4-oxadiazol-2-amine
CID 60202646
5-[3-[6-(cyclopropylmethylamino)pyrazin-2-yl]-1H-indol-5-yl]-1,3,4-oxadiazol-2-amine
CID 66554555
5-[3-[6-(propan-2-ylamino)pyrazin-2-yl]-1H-indol-5-yl]-1,3,4-oxadiazol-2-amine
CID 66554557
5-(3-(4-cyclopropylpyrimidin-2-yl)-1H-indol-5-yl)-N-(2,2,2-trifluoroethyl)-1,3,4-oxadiazol-2-amine
CID 66554727

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide?
The IUPAC name of N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide (CID 90257047) is N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide?
The canonical SMILES for N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide is CNC(=O)c1ccc(-c2c[nH]c3ccc(-c4nnc(NC(C)C)o4)cc23)nc1.
What is the InChIKey of N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide?
The InChIKey is GAXJBQGARSBXJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N6O2/c1-11(2)24-20-26-25-19(28-20)12-4-6-16-14(8-12)15(10-23-16)17-7-5-13(9-22-17)18(27)21-3/h4-11,23H,1-3H3,(H,21,27)(H,24,26).
What are the key properties of N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide?
N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide has a molecular weight of 376.42 g/mol, XLogP of 3.46, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[5-[5-(propan-2-ylamino)-1,3,4-oxadiazol-2-yl]-1H-indol-3-yl]pyridine-3-carboxamide is sourced from PubChem (CID 90257047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).