6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

C20H22N4O3 — CID 126794685

IUPAC6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCCCc1noc2nc(C3CC3)cc(C(=O)N(C)c3ncccc3OC)c12
InChIInChI=1S/C20H22N4O3/c1-4-6-14-17-13(11-15(12-8-9-12)22-19(17)27-23-14)20(25)24(2)18-16(26-3)7-5-10-21-18/h5,7,10-12H,4,6,8-9H2,1-3H3
InChIKeyIGJDICOVOTVLLK-UHFFFAOYSA-N
MW366.42 g/mol
LogP3.73
Rot. Bonds6

About 6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 126794685) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is 6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
PubChem CID126794685
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC Name6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCCCc1noc2nc(C3CC3)cc(C(=O)N(C)c3ncccc3OC)c12
InChIInChI=1S/C20H22N4O3/c1-4-6-14-17-13(11-15(12-8-9-12)22-19(17)27-23-14)20(25)24(2)18-16(26-3)7-5-10-21-18/h5,7,10-12H,4,6,8-9H2,1-3H3
InChIKeyIGJDICOVOTVLLK-UHFFFAOYSA-N
XLogP3.73
TPSA81.35 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (CID 126794685) is 6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is CCCc1noc2nc(C3CC3)cc(C(=O)N(C)c3ncccc3OC)c12.
What is the InChIKey of 6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is IGJDICOVOTVLLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-4-6-14-17-13(11-15(12-8-9-12)22-19(17)27-23-14)20(25)24(2)18-16(26-3)7-5-10-21-18/h5,7,10-12H,4,6,8-9H2,1-3H3.
What are the key properties of 6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 366.42 g/mol, XLogP of 3.73, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-(3-methoxy-2-pyridinyl)-N-methyl-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 126794685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).