N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide

C10H12N4O2 — CID 79523860

IUPACN-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide
SMILESCn1ncc(CNC(=O)c2ccoc2)c1N
InChIInChI=1S/C10H12N4O2/c1-14-9(11)8(5-13-14)4-12-10(15)7-2-3-16-6-7/h2-3,5-6H,4,11H2,1H3,(H,12,15)
InChIKeySAXRUDWFDCOQGR-UHFFFAOYSA-N
MW220.23 g/mol
LogP0.53
Rot. Bonds3

About N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide

N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide (PubChem CID 79523860) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide
PubChem CID79523860
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC NameN-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide
SMILESCn1ncc(CNC(=O)c2ccoc2)c1N
InChIInChI=1S/C10H12N4O2/c1-14-9(11)8(5-13-14)4-12-10(15)7-2-3-16-6-7/h2-3,5-6H,4,11H2,1H3,(H,12,15)
InChIKeySAXRUDWFDCOQGR-UHFFFAOYSA-N
XLogP0.53
TPSA86.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methylbenzamide
CID 79523593
N-[(5-amino-1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
CID 79524448
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-1H-pyrazole-4-carboxamide
CID 79523487
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-3-hydroxypyridine-2-carboxamide
CID 79523767
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-1H-indole-6-carboxamide
CID 79523236
1-[(5-amino-1-methylpyrazol-4-yl)methyl]-3-propan-2-ylurea
CID 79523783
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-fluoro-6-hydroxybenzamide
CID 107015976
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2,3-dichlorobenzamide
CID 79523235
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-5-fluoro-2-methylbenzamide
CID 79524292
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide
CID 79531446
3-[(5-amino-1-methylpyrazol-4-yl)methyl]-1-ethyl-1-methylurea
CID 79524208
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-3-methyl-2-nitrobenzamide
CID 79531428

Frequently Asked Questions

What is the IUPAC name of N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide?
The IUPAC name of N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide (CID 79523860) is N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide.
What is the SMILES notation for N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide?
The canonical SMILES for N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide is Cn1ncc(CNC(=O)c2ccoc2)c1N.
What is the InChIKey of N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide?
The InChIKey is SAXRUDWFDCOQGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-14-9(11)8(5-13-14)4-12-10(15)7-2-3-16-6-7/h2-3,5-6H,4,11H2,1H3,(H,12,15).
What are the key properties of N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide?
N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide has a molecular weight of 220.23 g/mol, XLogP of 0.53, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-amino-1-methylpyrazol-4-yl)methyl]furan-3-carboxamide is sourced from PubChem (CID 79523860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).