N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide

C19H24N4O3 — CID 42849956

IUPACN-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide
SMILESCCCCC(=O)N1CCN(c2ccc(NC(=O)c3ccco3)cn2)CC1
InChIInChI=1S/C19H24N4O3/c1-2-3-6-18(24)23-11-9-22(10-12-23)17-8-7-15(14-20-17)21-19(25)16-5-4-13-26-16/h4-5,7-8,13-14H,2-3,6,9-12H2,1H3,(H,21,25)
InChIKeyZWQZVHQTPDXLPE-UHFFFAOYSA-N
MW356.43 g/mol
LogP2.77
Rot. Bonds6

About N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide

N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide (PubChem CID 42849956) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide
PubChem CID42849956
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC NameN-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide
SMILESCCCCC(=O)N1CCN(c2ccc(NC(=O)c3ccco3)cn2)CC1
InChIInChI=1S/C19H24N4O3/c1-2-3-6-18(24)23-11-9-22(10-12-23)17-8-7-15(14-20-17)21-19(25)16-5-4-13-26-16/h4-5,7-8,13-14H,2-3,6,9-12H2,1H3,(H,21,25)
InChIKeyZWQZVHQTPDXLPE-UHFFFAOYSA-N
XLogP2.77
TPSA78.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-[4-(4-methylpentanoyl)piperazin-1-yl]-3-pyridinyl]furan-2-carboxamide
CID 46084240
N-[6-(4-pyridin-2-ylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide
CID 113014476
N-[6-(4-propan-2-ylsulfonylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide
CID 42857295
N-[6-[4-(furan-2-carbonyl)piperazin-1-yl]-3-pyridinyl]-4-methylbenzamide
CID 46041971
N-[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]furan-2-carboxamide
CID 1092657
N-[6-[4-(2-hydroxy-3-methylbutyl)-1,4-diazepan-1-yl]-3-pyridinyl]furan-2-carboxamide
CID 46054113
N-[6-[4-(thiophene-2-carbonyl)-1,4-diazepan-1-yl]-3-pyridinyl]furan-2-carboxamide
CID 46053082
N-[6-[4-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]piperazin-1-yl]-3-pyridinyl]furan-2-carboxamide
CID 42850252
N-[6-[4-(furan-2-carbonyl)piperazin-1-yl]-3-pyridinyl]-2-phenylacetamide
CID 46157200
N-[4-oxo-4-[(6-pyrrolidin-1-yl-3-pyridinyl)amino]butyl]furan-2-carboxamide
CID 30267377
N-[6-[4-(furan-2-carbonyl)piperazin-1-yl]-3-pyridinyl]-3-methylbutanamide
CID 46157166
N-[2-methyl-5-[(6-pyrrolidin-1-yl-3-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide
CID 30266978

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide?
The IUPAC name of N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide (CID 42849956) is N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide.
What is the SMILES notation for N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide?
The canonical SMILES for N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide is CCCCC(=O)N1CCN(c2ccc(NC(=O)c3ccco3)cn2)CC1.
What is the InChIKey of N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide?
The InChIKey is ZWQZVHQTPDXLPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-2-3-6-18(24)23-11-9-22(10-12-23)17-8-7-15(14-20-17)21-19(25)16-5-4-13-26-16/h4-5,7-8,13-14H,2-3,6,9-12H2,1H3,(H,21,25).
What are the key properties of N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide?
N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide has a molecular weight of 356.43 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-pentanoylpiperazin-1-yl)-3-pyridinyl]furan-2-carboxamide is sourced from PubChem (CID 42849956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).