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

C14H18N4O3 — CID 115619809

IUPACN-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide
SMILESCCCc1cc(NC(=O)CCNC(=O)c2ccco2)n[nH]1
InChIInChI=1S/C14H18N4O3/c1-2-4-10-9-12(18-17-10)16-13(19)6-7-15-14(20)11-5-3-8-21-11/h3,5,8-9H,2,4,6-7H2,1H3,(H,15,20)(H2,16,17,18,19)
InChIKeyGOVCUVAAKCWWNN-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.71
Rot. Bonds7

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

N-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide (PubChem CID 115619809) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is N-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide
PubChem CID115619809
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC NameN-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide
SMILESCCCc1cc(NC(=O)CCNC(=O)c2ccco2)n[nH]1
InChIInChI=1S/C14H18N4O3/c1-2-4-10-9-12(18-17-10)16-13(19)6-7-15-14(20)11-5-3-8-21-11/h3,5,8-9H,2,4,6-7H2,1H3,(H,15,20)(H2,16,17,18,19)
InChIKeyGOVCUVAAKCWWNN-UHFFFAOYSA-N
XLogP1.71
TPSA100.02 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[(3-ethoxy-1H-1,2,4-triazol-5-yl)amino]-3-oxopropyl]furan-2-carboxamide
CID 104817180
N-[3-oxo-3-(1H-pyrazol-5-ylamino)propyl]furan-2-carboxamide
CID 61393596
N-[3-(3,4-dipropoxyanilino)-3-oxopropyl]furan-2-carboxamide
CID 26878579
N-[1-[(5-ethyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 47423183
3-[[2-(furan-2-carbonylamino)acetyl]amino]-1H-pyrazole-5-carboxylic acid
CID 64528451
3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propanoic acid
CID 104621777
2-(4-methylphenyl)-N-(5-propyl-1H-pyrazol-3-yl)acetamide
CID 112690378
N-(5-propyl-1H-pyrazol-3-yl)-2-pyridin-4-ylacetamide
CID 112680470
N-[2-(pentanoylamino)ethyl]furan-2-carboxamide
CID 33189840
N-[3-(4-ethylsulfonylanilino)-3-oxopropyl]furan-2-carboxamide
CID 46693911
N-[3-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide
CID 2114344
N-[3-(2-ethylbutylamino)-3-oxopropyl]furan-2-carboxamide
CID 115612648

Frequently Asked Questions

What is the IUPAC name of N-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide?
The IUPAC name of N-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide (CID 115619809) is N-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide?
The canonical SMILES for N-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide is CCCc1cc(NC(=O)CCNC(=O)c2ccco2)n[nH]1.
What is the InChIKey of N-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide?
The InChIKey is GOVCUVAAKCWWNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c1-2-4-10-9-12(18-17-10)16-13(19)6-7-15-14(20)11-5-3-8-21-11/h3,5,8-9H,2,4,6-7H2,1H3,(H,15,20)(H2,16,17,18,19).
What are the key properties of N-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide?
N-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide has a molecular weight of 290.32 g/mol, XLogP of 1.71, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propyl]furan-2-carboxamide is sourced from PubChem (CID 115619809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).