N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide

C12H14N4O3 — CID 47289682

IUPACN-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
SMILESCc1cc(NC(=O)C(C)NC(=O)c2ccco2)n[nH]1
InChIInChI=1S/C12H14N4O3/c1-7-6-10(16-15-7)14-11(17)8(2)13-12(18)9-4-3-5-19-9/h3-6,8H,1-2H3,(H,13,18)(H2,14,15,16,17)
InChIKeyNZIPJUILPVKQFE-UHFFFAOYSA-N
MW262.27 g/mol
LogP1.07
Rot. Bonds4

About N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide

N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide (PubChem CID 47289682) has the molecular formula C12H14N4O3 and a molecular weight of 262.27 g/mol. Its IUPAC name is N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
PubChem CID47289682
Molecular FormulaC12H14N4O3
Molecular Weight262.27 g/mol
Exact Mass262.11
IUPAC NameN-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
SMILESCc1cc(NC(=O)C(C)NC(=O)c2ccco2)n[nH]1
InChIInChI=1S/C12H14N4O3/c1-7-6-10(16-15-7)14-11(17)8(2)13-12(18)9-4-3-5-19-9/h3-6,8H,1-2H3,(H,13,18)(H2,14,15,16,17)
InChIKeyNZIPJUILPVKQFE-UHFFFAOYSA-N
XLogP1.07
TPSA100.02 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 51.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[(5-ethyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 47423183
2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 63819909
N-[(2R)-1-anilino-1-oxopropan-2-yl]furan-2-carboxamide
CID 42561606
N-[(2S)-1-(4-acetamidoanilino)-1-oxopropan-2-yl]furan-2-carboxamide
CID 2534154
N-[1-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 47098607
N-[(2S)-1-oxo-1-[4-(pyrimidin-2-ylamino)anilino]propan-2-yl]furan-2-carboxamide
CID 146098608
N-[1-(3-iodoanilino)-1-oxopropan-2-yl]furan-2-carboxamide
CID 24664556
2-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 117099978
(2S)-2-(furan-2-carbonylamino)propanoic acid
CID 792932
N-[(2S)-1-(1H-benzimidazol-2-ylamino)-1-oxopropan-2-yl]furan-2-carboxamide
CID 35808153
N-[(2R)-1-oxo-1-[3-(trifluoromethyl)anilino]propan-2-yl]furan-2-carboxamide
CID 42561579
N-[1-[[1-(ethylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 47112949

Frequently Asked Questions

What is the IUPAC name of N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide?
The IUPAC name of N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide (CID 47289682) is N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide is Cc1cc(NC(=O)C(C)NC(=O)c2ccco2)n[nH]1.
What is the InChIKey of N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide?
The InChIKey is NZIPJUILPVKQFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O3/c1-7-6-10(16-15-7)14-11(17)8(2)13-12(18)9-4-3-5-19-9/h3-6,8H,1-2H3,(H,13,18)(H2,14,15,16,17).
What are the key properties of N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide?
N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide has a molecular weight of 262.27 g/mol, XLogP of 1.07, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide is sourced from PubChem (CID 47289682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).