N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide

C15H18N2O3 — CID 110786846

IUPACN-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide
SMILESCn1c(=O)oc2ccc(CNC(=O)C3CCCC3)cc21
InChIInChI=1S/C15H18N2O3/c1-17-12-8-10(6-7-13(12)20-15(17)19)9-16-14(18)11-4-2-3-5-11/h6-8,11H,2-5,9H2,1H3,(H,16,18)
InChIKeyQSOSSUPFUMKDKZ-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.94
Rot. Bonds3

About N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide

N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide (PubChem CID 110786846) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide
PubChem CID110786846
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC NameN-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide
SMILESCn1c(=O)oc2ccc(CNC(=O)C3CCCC3)cc21
InChIInChI=1S/C15H18N2O3/c1-17-12-8-10(6-7-13(12)20-15(17)19)9-16-14(18)11-4-2-3-5-11/h6-8,11H,2-5,9H2,1H3,(H,16,18)
InChIKeyQSOSSUPFUMKDKZ-UHFFFAOYSA-N
XLogP1.94
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl]cyclohexanecarboxamide
CID 110785342
N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]-2-azaspiro[3.4]octane-3-carboxamide
CID 167747676
3-chloro-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]propanamide
CID 115162534
1-tert-butyl-3-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]urea
CID 110775584
N-[2-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide
CID 110792130
1-cyclopentyl-3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)methyl]urea
CID 110775565
N-[(1S)-1-cyano-2-[4-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)phenyl]ethyl]cyclohexanecarboxamide
CID 170754468
N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]-3-phenylpropanamide
CID 110786871
N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]-2-(2-methylphenyl)acetamide
CID 110786905
2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 110774127
7-(cyclohexylmethylamino)-5-methyl-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]pyrrolo[3,2-d]pyrimidine-4-carboxamide
CID 91349676
N-[(3,4-difluorophenyl)methyl]cyclopentanecarboxamide
CID 110781018

Frequently Asked Questions

What is the IUPAC name of N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide?
The IUPAC name of N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide (CID 110786846) is N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide?
The canonical SMILES for N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide is Cn1c(=O)oc2ccc(CNC(=O)C3CCCC3)cc21.
What is the InChIKey of N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide?
The InChIKey is QSOSSUPFUMKDKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-17-12-8-10(6-7-13(12)20-15(17)19)9-16-14(18)11-4-2-3-5-11/h6-8,11H,2-5,9H2,1H3,(H,16,18).
What are the key properties of N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide?
N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide has a molecular weight of 274.32 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]cyclopentanecarboxamide is sourced from PubChem (CID 110786846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).