N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide

C14H15F2N3O2 — CID 86852731

IUPACN-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide
SMILESCN(Cc1nccn1C(F)F)C(=O)C1CC1c1ccco1
InChIInChI=1S/C14H15F2N3O2/c1-18(8-12-17-4-5-19(12)14(15)16)13(20)10-7-9(10)11-3-2-6-21-11/h2-6,9-10,14H,7-8H2,1H3
InChIKeyFFJJQZGGYZGROS-UHFFFAOYSA-N
MW295.29 g/mol
LogP2.63
Rot. Bonds5

About N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide

N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide (PubChem CID 86852731) has the molecular formula C14H15F2N3O2 and a molecular weight of 295.29 g/mol. Its IUPAC name is N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide
PubChem CID86852731
Molecular FormulaC14H15F2N3O2
Molecular Weight295.29 g/mol
Exact Mass295.11
IUPAC NameN-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide
SMILESCN(Cc1nccn1C(F)F)C(=O)C1CC1c1ccco1
InChIInChI=1S/C14H15F2N3O2/c1-18(8-12-17-4-5-19(12)14(15)16)13(20)10-7-9(10)11-3-2-6-21-11/h2-6,9-10,14H,7-8H2,1H3
InChIKeyFFJJQZGGYZGROS-UHFFFAOYSA-N
XLogP2.63
TPSA51.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.29
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide?
The IUPAC name of N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide (CID 86852731) is N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide is CN(Cc1nccn1C(F)F)C(=O)C1CC1c1ccco1.
What is the InChIKey of N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide?
The InChIKey is FFJJQZGGYZGROS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2N3O2/c1-18(8-12-17-4-5-19(12)14(15)16)13(20)10-7-9(10)11-3-2-6-21-11/h2-6,9-10,14H,7-8H2,1H3.
What are the key properties of N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide?
N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide has a molecular weight of 295.29 g/mol, XLogP of 2.63, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(furan-2-yl)-N-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 86852731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).