N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide

C19H18N2O3 — CID 75405611

IUPACN-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
SMILESCc1nc(-c2ccc(NC(=O)C3CC3c3ccco3)cc2)oc1C
InChIInChI=1S/C19H18N2O3/c1-11-12(2)24-19(20-11)13-5-7-14(8-6-13)21-18(22)16-10-15(16)17-4-3-9-23-17/h3-9,15-16H,10H2,1-2H3,(H,21,22)
InChIKeyQSJTWJQRWGNVCR-UHFFFAOYSA-N
MW322.36 g/mol
LogP4.29
Rot. Bonds4

About N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide

N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide (PubChem CID 75405611) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
PubChem CID75405611
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC NameN-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
SMILESCc1nc(-c2ccc(NC(=O)C3CC3c3ccco3)cc2)oc1C
InChIInChI=1S/C19H18N2O3/c1-11-12(2)24-19(20-11)13-5-7-14(8-6-13)21-18(22)16-10-15(16)17-4-3-9-23-17/h3-9,15-16H,10H2,1-2H3,(H,21,22)
InChIKeyQSJTWJQRWGNVCR-UHFFFAOYSA-N
XLogP4.29
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-furyl)-N-(2-methylphenyl)-4-quinolinecarboxamide
CID 868692
N-[4-(1,3-benzoxazol-2-yl)phenyl]oxolane-2-carboxamide
CID 2941074
3-[2-(6-Methylbenzoxazol-2-yl)ethyl]-5-ethyl-6-methylpyridin-2(1H)-one
CID 454808
4-ethoxy-N-[4-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]benzamide
CID 1109008
N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-propoxybenzamide
CID 1717292
N-(2-Ethylphenyl)-2-(propan-2-YL)-1,3-benzoxazole-6-carboxamide
CID 16029716
N-(4-Ethylphenyl)-2-(propan-2-YL)-1,3-benzoxazole-6-carboxamide
CID 16029718
N-(4-ethoxyphenyl)-2-propan-2-yl-1,3-benzoxazole-6-carboxamide
CID 16029722
2-benzyl-N-(3-methoxyphenyl)-1,3-benzoxazole-6-carboxamide
CID 16029732
4-ethoxy-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide
CID 1108999
2,2-Dimethyl-N-[4-(2-methyl-5-phenyl-4-oxazolyl)phenyl]propanamide
CID 2801422
N-(4-methoxyphenyl)-2-(2-phenylethyl)-1,3-benzoxazole-6-carboxamide
CID 16029872

Frequently Asked Questions

What is the IUPAC name of N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide?
The IUPAC name of N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide (CID 75405611) is N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide?
The canonical SMILES for N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide is Cc1nc(-c2ccc(NC(=O)C3CC3c3ccco3)cc2)oc1C.
What is the InChIKey of N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide?
The InChIKey is QSJTWJQRWGNVCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-11-12(2)24-19(20-11)13-5-7-14(8-6-13)21-18(22)16-10-15(16)17-4-3-9-23-17/h3-9,15-16H,10H2,1-2H3,(H,21,22).
What are the key properties of N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide?
N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide has a molecular weight of 322.36 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 75405611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).