N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide

C19H24N2O3 — CID 110670105

IUPACN-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide
SMILESCc1cccc(CN(CCN2CCOCC2)C(=O)c2ccco2)c1
InChIInChI=1S/C19H24N2O3/c1-16-4-2-5-17(14-16)15-21(19(22)18-6-3-11-24-18)8-7-20-9-12-23-13-10-20/h2-6,11,14H,7-10,12-13,15H2,1H3
InChIKeyHRZWWXGEIVRIPX-UHFFFAOYSA-N
MW328.41 g/mol
LogP2.56
Rot. Bonds6

About N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide

N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide (PubChem CID 110670105) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide
PubChem CID110670105
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC NameN-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide
SMILESCc1cccc(CN(CCN2CCOCC2)C(=O)c2ccco2)c1
InChIInChI=1S/C19H24N2O3/c1-16-4-2-5-17(14-16)15-21(19(22)18-6-3-11-24-18)8-7-20-9-12-23-13-10-20/h2-6,11,14H,7-10,12-13,15H2,1H3
InChIKeyHRZWWXGEIVRIPX-UHFFFAOYSA-N
XLogP2.56
TPSA45.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide?
The IUPAC name of N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide (CID 110670105) is N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide.
What is the SMILES notation for N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide?
The canonical SMILES for N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide is Cc1cccc(CN(CCN2CCOCC2)C(=O)c2ccco2)c1.
What is the InChIKey of N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide?
The InChIKey is HRZWWXGEIVRIPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-16-4-2-5-17(14-16)15-21(19(22)18-6-3-11-24-18)8-7-20-9-12-23-13-10-20/h2-6,11,14H,7-10,12-13,15H2,1H3.
What are the key properties of N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide?
N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide has a molecular weight of 328.41 g/mol, XLogP of 2.56, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide is sourced from PubChem (CID 110670105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).