N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide

C14H18N4O2 — CID 53138212

IUPACN-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide
SMILESCc1nc(Cn2cccc2C(=O)NC2CCCC2)no1
InChIInChI=1S/C14H18N4O2/c1-10-15-13(17-20-10)9-18-8-4-7-12(18)14(19)16-11-5-2-3-6-11/h4,7-8,11H,2-3,5-6,9H2,1H3,(H,16,19)
InChIKeyBZHJGQLVYPYHDM-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.90
Rot. Bonds4

About N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide

N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide (PubChem CID 53138212) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide
PubChem CID53138212
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC NameN-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide
SMILESCc1nc(Cn2cccc2C(=O)NC2CCCC2)no1
InChIInChI=1S/C14H18N4O2/c1-10-15-13(17-20-10)9-18-8-4-7-12(18)14(19)16-11-5-2-3-6-11/h4,7-8,11H,2-3,5-6,9H2,1H3,(H,16,19)
InChIKeyBZHJGQLVYPYHDM-UHFFFAOYSA-N
XLogP1.90
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide?
The IUPAC name of N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide (CID 53138212) is N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide?
The canonical SMILES for N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide is Cc1nc(Cn2cccc2C(=O)NC2CCCC2)no1.
What is the InChIKey of N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide?
The InChIKey is BZHJGQLVYPYHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-10-15-13(17-20-10)9-18-8-4-7-12(18)14(19)16-11-5-2-3-6-11/h4,7-8,11H,2-3,5-6,9H2,1H3,(H,16,19).
What are the key properties of N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide?
N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrole-2-carboxamide is sourced from PubChem (CID 53138212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).