5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide

C20H24N4O3 — CID 71087853

IUPAC5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide
SMILESCc1nc(C(NC(=O)c2ccc(C3CC3)c(OCC3CC3)n2)C2CC2)no1
InChIInChI=1S/C20H24N4O3/c1-11-21-18(24-27-11)17(14-6-7-14)23-19(25)16-9-8-15(13-4-5-13)20(22-16)26-10-12-2-3-12/h8-9,12-14,17H,2-7,10H2,1H3,(H,23,25)
InChIKeyLIVIAQCOPGNLQD-UHFFFAOYSA-N
MW368.44 g/mol
LogP3.32
Rot. Bonds8

About 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide

5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide (PubChem CID 71087853) has the molecular formula C20H24N4O3 and a molecular weight of 368.44 g/mol. Its IUPAC name is 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide
PubChem CID71087853
Molecular FormulaC20H24N4O3
Molecular Weight368.44 g/mol
Exact Mass368.18
IUPAC Name5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide
SMILESCc1nc(C(NC(=O)c2ccc(C3CC3)c(OCC3CC3)n2)C2CC2)no1
InChIInChI=1S/C20H24N4O3/c1-11-21-18(24-27-11)17(14-6-7-14)23-19(25)16-9-8-15(13-4-5-13)20(22-16)26-10-12-2-3-12/h8-9,12-14,17H,2-7,10H2,1H3,(H,23,25)
InChIKeyLIVIAQCOPGNLQD-UHFFFAOYSA-N
XLogP3.32
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.44
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide?
The IUPAC name of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide (CID 71087853) is 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide is Cc1nc(C(NC(=O)c2ccc(C3CC3)c(OCC3CC3)n2)C2CC2)no1.
What is the InChIKey of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide?
The InChIKey is LIVIAQCOPGNLQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O3/c1-11-21-18(24-27-11)17(14-6-7-14)23-19(25)16-9-8-15(13-4-5-13)20(22-16)26-10-12-2-3-12/h8-9,12-14,17H,2-7,10H2,1H3,(H,23,25).
What are the key properties of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide?
5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide has a molecular weight of 368.44 g/mol, XLogP of 3.32, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 71087853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).