N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide

C17H16N4O2 — CID 155527966

IUPACN-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide
SMILESCc1nc(-c2ccnc(NC(=O)C3CC3)c2)c(-c2ccco2)[nH]1
InChIInChI=1S/C17H16N4O2/c1-10-19-15(16(20-10)13-3-2-8-23-13)12-6-7-18-14(9-12)21-17(22)11-4-5-11/h2-3,6-9,11H,4-5H2,1H3,(H,19,20)(H,18,21,22)
InChIKeyORASXEURMWARRB-UHFFFAOYSA-N
MW308.34 g/mol
LogP3.39
Rot. Bonds4

About N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide

N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide (PubChem CID 155527966) has the molecular formula C17H16N4O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide
PubChem CID155527966
Molecular FormulaC17H16N4O2
Molecular Weight308.34 g/mol
Exact Mass308.13
IUPAC NameN-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide
SMILESCc1nc(-c2ccnc(NC(=O)C3CC3)c2)c(-c2ccco2)[nH]1
InChIInChI=1S/C17H16N4O2/c1-10-19-15(16(20-10)13-3-2-8-23-13)12-6-7-18-14(9-12)21-17(22)11-4-5-11/h2-3,6-9,11H,4-5H2,1H3,(H,19,20)(H,18,21,22)
InChIKeyORASXEURMWARRB-UHFFFAOYSA-N
XLogP3.39
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide (CID 155527966) is N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide is Cc1nc(-c2ccnc(NC(=O)C3CC3)c2)c(-c2ccco2)[nH]1.
What is the InChIKey of N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide?
The InChIKey is ORASXEURMWARRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2/c1-10-19-15(16(20-10)13-3-2-8-23-13)12-6-7-18-14(9-12)21-17(22)11-4-5-11/h2-3,6-9,11H,4-5H2,1H3,(H,19,20)(H,18,21,22).
What are the key properties of N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide?
N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide has a molecular weight of 308.34 g/mol, XLogP of 3.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[5-(furan-2-yl)-2-methyl-1H-imidazol-4-yl]-2-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 155527966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).