N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide

C14H16N2O2 — CID 110791040

IUPACN-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide
SMILESCc1nc2ccc(CCNC(=O)C3CC3)cc2o1
InChIInChI=1S/C14H16N2O2/c1-9-16-12-5-2-10(8-13(12)18-9)6-7-15-14(17)11-3-4-11/h2,5,8,11H,3-4,6-7H2,1H3,(H,15,17)
InChIKeyKUTRZUXFUPKMOR-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.20
Rot. Bonds4

About N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide

N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide (PubChem CID 110791040) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide
PubChem CID110791040
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide
SMILESCc1nc2ccc(CCNC(=O)C3CC3)cc2o1
InChIInChI=1S/C14H16N2O2/c1-9-16-12-5-2-10(8-13(12)18-9)6-7-15-14(17)11-3-4-11/h2,5,8,11H,3-4,6-7H2,1H3,(H,15,17)
InChIKeyKUTRZUXFUPKMOR-UHFFFAOYSA-N
XLogP2.20
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(2-methyl-1,3-benzoxazol-5-yl)ethyl]cyclopropanecarboxamide
CID 110707465
N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]propanamide
CID 110791037
1-methyl-3-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]urea
CID 115169390
3-methyl-N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]butanamide
CID 110791042
2-(4-fluorophenyl)-N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]acetamide
CID 110791067
N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]pyridine-4-carboxamide
CID 110791080
N-[3-(2-methyl-1,3-benzoxazol-6-yl)propyl]cyclopropanamine
CID 96672948
N-[2-(1,3-benzoxazol-6-yl)ethyl]cyclohexanecarboxamide
CID 110790911
2-(3-fluorophenyl)-N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]acetamide
CID 110791108
N-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropanecarboxamide
CID 110787330
N-[2-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide
CID 110792130
N-[(2-methyl-1,3-benzoxazol-6-yl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 110794636

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide (CID 110791040) is N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide is Cc1nc2ccc(CCNC(=O)C3CC3)cc2o1.
What is the InChIKey of N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide?
The InChIKey is KUTRZUXFUPKMOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-9-16-12-5-2-10(8-13(12)18-9)6-7-15-14(17)11-3-4-11/h2,5,8,11H,3-4,6-7H2,1H3,(H,15,17).
What are the key properties of N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide?
N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide has a molecular weight of 244.29 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methyl-1,3-benzoxazol-6-yl)ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 110791040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).