N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide

C11H15NO4 — CID 110359265

IUPACN-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide
SMILESCC1(CCNC(=O)c2ccco2)OCCO1
InChIInChI=1S/C11H15NO4/c1-11(15-7-8-16-11)4-5-12-10(13)9-3-2-6-14-9/h2-3,6H,4-5,7-8H2,1H3,(H,12,13)
InChIKeyYRNYVLZCRUFMCE-UHFFFAOYSA-N
MW225.24 g/mol
LogP1.16
Rot. Bonds4

About N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide

N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide (PubChem CID 110359265) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide
PubChem CID110359265
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC NameN-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide
SMILESCC1(CCNC(=O)c2ccco2)OCCO1
InChIInChI=1S/C11H15NO4/c1-11(15-7-8-16-11)4-5-12-10(13)9-3-2-6-14-9/h2-3,6H,4-5,7-8H2,1H3,(H,12,13)
InChIKeyYRNYVLZCRUFMCE-UHFFFAOYSA-N
XLogP1.16
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2,2-dimethyl-4-propyloxan-4-yl)ethyl]furan-2-carboxamide
CID 71827324
N-[10-(furan-2-carbonylamino)decyl]furan-2-carboxamide
CID 3147438
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-3-phenylbenzamide
CID 110359324
N-[2-[(4-ethylbenzoyl)amino]ethyl]furan-2-carboxamide
CID 134052250
N-[(1-methylcyclobutyl)methyl]furan-2-carboxamide
CID 103737372
3-(furan-2-carbonylamino)propanoic acid
CID 762504
4-methyl-N-[2-(2-methyl-1,3-dioxan-2-yl)ethyl]benzamide
CID 110369745
N-(2-morpholin-4-ium-4-ylethyl)furan-2-carboxamide
CID 7720034
N-[2-[(2-chloroacetyl)amino]ethyl]furan-2-carboxamide
CID 108571159
N-pent-3-ynylfuran-2-carboxamide
CID 115977286
N-(4-methoxybutyl)furan-2-carboxamide
CID 60769533
N-[3-(ethylamino)propyl]furan-2-carboxamide
CID 43601657

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide (CID 110359265) is N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide is CC1(CCNC(=O)c2ccco2)OCCO1.
What is the InChIKey of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide?
The InChIKey is YRNYVLZCRUFMCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-11(15-7-8-16-11)4-5-12-10(13)9-3-2-6-14-9/h2-3,6H,4-5,7-8H2,1H3,(H,12,13).
What are the key properties of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide?
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide has a molecular weight of 225.24 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]furan-2-carboxamide is sourced from PubChem (CID 110359265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).