N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

C18H24N4O2 — CID 134789890

IUPACN-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCCC2)c2c(C3CCNCC3)noc2n1
InChIInChI=1S/C18H24N4O2/c1-11-10-14(17(23)21-13-4-2-3-5-13)15-16(22-24-18(15)20-11)12-6-8-19-9-7-12/h10,12-13,19H,2-9H2,1H3,(H,21,23)
InChIKeyYJJQYDMGTLSZKQ-UHFFFAOYSA-N
MW328.42 g/mol
LogP2.67
Rot. Bonds3

About N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 134789890) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
PubChem CID134789890
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC NameN-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCCC2)c2c(C3CCNCC3)noc2n1
InChIInChI=1S/C18H24N4O2/c1-11-10-14(17(23)21-13-4-2-3-5-13)15-16(22-24-18(15)20-11)12-6-8-19-9-7-12/h10,12-13,19H,2-9H2,1H3,(H,21,23)
InChIKeyYJJQYDMGTLSZKQ-UHFFFAOYSA-N
XLogP2.67
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (CID 134789890) is N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is Cc1cc(C(=O)NC2CCCC2)c2c(C3CCNCC3)noc2n1.
What is the InChIKey of N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is YJJQYDMGTLSZKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-11-10-14(17(23)21-13-4-2-3-5-13)15-16(22-24-18(15)20-11)12-6-8-19-9-7-12/h10,12-13,19H,2-9H2,1H3,(H,21,23).
What are the key properties of N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 2.67, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-methyl-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 134789890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).