N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide

C18H17N3O2 — CID 22176870

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide
SMILESO=C(Cc1ccc(-c2ccco2)cc1)Nc1cc(C2CC2)[nH]n1
InChIInChI=1S/C18H17N3O2/c22-18(19-17-11-15(20-21-17)13-7-8-13)10-12-3-5-14(6-4-12)16-2-1-9-23-16/h1-6,9,11,13H,7-8,10H2,(H2,19,20,21,22)
InChIKeyNCHZJIURSRRCML-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.73
Rot. Bonds5

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide (PubChem CID 22176870) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide
PubChem CID22176870
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide
SMILESO=C(Cc1ccc(-c2ccco2)cc1)Nc1cc(C2CC2)[nH]n1
InChIInChI=1S/C18H17N3O2/c22-18(19-17-11-15(20-21-17)13-7-8-13)10-12-3-5-14(6-4-12)16-2-1-9-23-16/h1-6,9,11,13H,7-8,10H2,(H2,19,20,21,22)
InChIKeyNCHZJIURSRRCML-UHFFFAOYSA-N
XLogP3.73
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide (CID 22176870) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide is O=C(Cc1ccc(-c2ccco2)cc1)Nc1cc(C2CC2)[nH]n1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide?
The InChIKey is NCHZJIURSRRCML-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c22-18(19-17-11-15(20-21-17)13-7-8-13)10-12-3-5-14(6-4-12)16-2-1-9-23-16/h1-6,9,11,13H,7-8,10H2,(H2,19,20,21,22).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide has a molecular weight of 307.35 g/mol, XLogP of 3.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(furan-2-yl)phenyl]acetamide is sourced from PubChem (CID 22176870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).