N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide

C15H13N3O2 — CID 9034607

IUPACN-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide
SMILESO=C(NCc1ccco1)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C15H13N3O2/c19-15(16-10-14-7-4-8-20-14)12-9-17-18(11-12)13-5-2-1-3-6-13/h1-9,11H,10H2,(H,16,19)
InChIKeyYSQDZQJGFGIOSC-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.40
Rot. Bonds4

About N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide

N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide (PubChem CID 9034607) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide
PubChem CID9034607
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC NameN-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide
SMILESO=C(NCc1ccco1)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C15H13N3O2/c19-15(16-10-14-7-4-8-20-14)12-9-17-18(11-12)13-5-2-1-3-6-13/h1-9,11H,10H2,(H,16,19)
InChIKeyYSQDZQJGFGIOSC-UHFFFAOYSA-N
XLogP2.40
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(furan-2-ylmethylcarbamoyl)pyrazol-1-yl]acetic acid
CID 19621941
1-(4-chlorophenyl)-N-[2-(furan-2-yl)ethyl]pyrazole-4-carboxamide
CID 50772791
N-(naphthalen-1-ylmethyl)-1-phenylpyrazole-4-carboxamide
CID 78851836
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpyrazole-4-carboxamide
CID 86836292
[2-(furan-2-ylmethylamino)-2-oxoethyl] 2-(1-phenylpyrazol-4-yl)acetate
CID 32932137
N-[(2S)-2-hydroxypropyl]-1-phenylpyrazole-4-carboxamide
CID 83030878
N-(3-amino-3-sulfanylidenepropyl)-1-phenylpyrazole-4-carboxamide
CID 55101990
N-(1,3-benzothiazol-2-ylmethyl)-1-phenylpyrazole-4-carboxamide
CID 24543290
N-(2-aminophenyl)-1-phenylpyrazole-4-carboxamide
CID 28742301
2-[[(1-phenylpyrazole-4-carbonyl)amino]methyl]butanoic acid
CID 65219117
1-ethyl-3-(furan-2-ylmethyl)-2-[(1-phenylpyrazol-4-yl)methyl]guanidine
CID 110938804
1-N,3-N-bis(furan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 743261

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide (CID 9034607) is N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide is O=C(NCc1ccco1)c1cnn(-c2ccccc2)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide?
The InChIKey is YSQDZQJGFGIOSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c19-15(16-10-14-7-4-8-20-14)12-9-17-18(11-12)13-5-2-1-3-6-13/h1-9,11H,10H2,(H,16,19).
What are the key properties of N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide?
N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide is sourced from PubChem (CID 9034607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).