5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide

C13H18N4O2 — CID 43430673

IUPAC5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide
SMILESCCN(CC)Cc1ccc(C(=O)Nc2cn[nH]c2)o1
InChIInChI=1S/C13H18N4O2/c1-3-17(4-2)9-11-5-6-12(19-11)13(18)16-10-7-14-15-8-10/h5-8H,3-4,9H2,1-2H3,(H,14,15)(H,16,18)
InChIKeyNWJVMNGGSFRWAQ-UHFFFAOYSA-N
MW262.31 g/mol
LogP2.10
Rot. Bonds6

About 5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide

5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide (PubChem CID 43430673) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is 5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide
PubChem CID43430673
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC Name5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide
SMILESCCN(CC)Cc1ccc(C(=O)Nc2cn[nH]c2)o1
InChIInChI=1S/C13H18N4O2/c1-3-17(4-2)9-11-5-6-12(19-11)13(18)16-10-7-14-15-8-10/h5-8H,3-4,9H2,1-2H3,(H,14,15)(H,16,18)
InChIKeyNWJVMNGGSFRWAQ-UHFFFAOYSA-N
XLogP2.10
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(diethylaminomethyl)-N'-propanoylfuran-2-carbohydrazide
CID 56807423
2-[[5-(diethylaminomethyl)furan-2-carbonyl]amino]acetic acid
CID 43354372
N-(2-amino-2-oxoethoxy)-5-(diethylaminomethyl)furan-2-carboxamide
CID 112550624
5-(diethylaminomethyl)-N-(4-hydroxybutyl)furan-2-carboxamide
CID 106843281
5-(diethylaminomethyl)-N-[1-(hydroxymethyl)cyclopentyl]furan-2-carboxamide
CID 62517028
2-[[5-(diethylaminomethyl)furan-2-carbonyl]amino]-3-hydroxybutanoic acid
CID 43170259
3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide
CID 43429619
5-(diethylaminomethyl)-N'-[3-(4-methoxyphenyl)propanoyl]furan-2-carbohydrazide
CID 47837306
5-[[benzyl-[(4-methylphenyl)methyl]amino]methyl]-N-(4-fluorophenyl)furan-2-carboxamide
CID 5110076
4-(methylamino)-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 81242635
N-[4-(diethylamino)phenyl]-5-(methoxymethyl)furan-2-carboxamide
CID 30838668
4-amino-1-ethyl-N-(1H-pyrazol-4-yl)pyrazole-5-carboxamide
CID 65357048

Frequently Asked Questions

What is the IUPAC name of 5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide?
The IUPAC name of 5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide (CID 43430673) is 5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide.
What is the SMILES notation for 5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide?
The canonical SMILES for 5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide is CCN(CC)Cc1ccc(C(=O)Nc2cn[nH]c2)o1.
What is the InChIKey of 5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide?
The InChIKey is NWJVMNGGSFRWAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c1-3-17(4-2)9-11-5-6-12(19-11)13(18)16-10-7-14-15-8-10/h5-8H,3-4,9H2,1-2H3,(H,14,15)(H,16,18).
What are the key properties of 5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide?
5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 2.10, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(diethylaminomethyl)-N-(1H-pyrazol-4-yl)furan-2-carboxamide is sourced from PubChem (CID 43430673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).