N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide

C9H12N2O2 — CID 53017058

IUPACN-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide
SMILESCc1cc(CNC(=O)C2CC2)on1
InChIInChI=1S/C9H12N2O2/c1-6-4-8(13-11-6)5-10-9(12)7-2-3-7/h4,7H,2-3,5H2,1H3,(H,10,12)
InChIKeyHVHFNCCXEUTSSE-UHFFFAOYSA-N
MW180.21 g/mol
LogP1.01
Rot. Bonds3

About N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide

N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide (PubChem CID 53017058) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide
PubChem CID53017058
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC NameN-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide
SMILESCc1cc(CNC(=O)C2CC2)on1
InChIInChI=1S/C9H12N2O2/c1-6-4-8(13-11-6)5-10-9(12)7-2-3-7/h4,7H,2-3,5H2,1H3,(H,10,12)
InChIKeyHVHFNCCXEUTSSE-UHFFFAOYSA-N
XLogP1.01
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119755255
2-amino-N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropane-1-carboxamide
CID 82237400
N-[(3-methyl-1,2-oxazol-5-yl)methyl]azepane-2-carboxamide
CID 64569142
1-(4-fluorophenyl)sulfonyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide
CID 49083017
(3S)-1-cycloheptyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-6-oxopiperidine-3-carboxamide
CID 42241808
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 49082877
methyl N-[(3-methyl-1,2-oxazol-5-yl)methyl]carbamate
CID 115598489
1-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methyl]urea
CID 53017221
(4S)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 97014181
1-(cyclooctylmethyl)-3-[(3-methyl-1,2-oxazol-5-yl)methyl]urea
CID 71881577
1-ethyl-3-[(3-methyl-1,2-oxazol-5-yl)methyl]urea
CID 53017228
(2R,3S)-2-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]morpholine-3-carboxamide;hydrochloride
CID 120928446

Frequently Asked Questions

What is the IUPAC name of N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide (CID 53017058) is N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide is Cc1cc(CNC(=O)C2CC2)on1.
What is the InChIKey of N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide?
The InChIKey is HVHFNCCXEUTSSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c1-6-4-8(13-11-6)5-10-9(12)7-2-3-7/h4,7H,2-3,5H2,1H3,(H,10,12).
What are the key properties of N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide?
N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide has a molecular weight of 180.21 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 53017058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).