N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide

C19H20N4O3 — CID 78868846

IUPACN-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide
SMILESCc1ccc2[nH]nc(C(=O)NC3CCN(C(=O)c4ccco4)CC3)c2c1
InChIInChI=1S/C19H20N4O3/c1-12-4-5-15-14(11-12)17(22-21-15)18(24)20-13-6-8-23(9-7-13)19(25)16-3-2-10-26-16/h2-5,10-11,13H,6-9H2,1H3,(H,20,24)(H,21,22)
InChIKeyNRTYEMPGODHTAE-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.50
Rot. Bonds3

About N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide

N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide (PubChem CID 78868846) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide
PubChem CID78868846
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC NameN-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide
SMILESCc1ccc2[nH]nc(C(=O)NC3CCN(C(=O)c4ccco4)CC3)c2c1
InChIInChI=1S/C19H20N4O3/c1-12-4-5-15-14(11-12)17(22-21-15)18(24)20-13-6-8-23(9-7-13)19(25)16-3-2-10-26-16/h2-5,10-11,13H,6-9H2,1H3,(H,20,24)(H,21,22)
InChIKeyNRTYEMPGODHTAE-UHFFFAOYSA-N
XLogP2.50
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(furan-2-carbonylamino)ethyl]-5-methyl-1H-indazole-3-carboxamide
CID 78869375
N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-methylbenzamide
CID 16613592
N-[1-(furan-2-carbonyl)piperidin-4-yl]-2-hydroxy-5-methylbenzamide
CID 134000252
N-(1-acetylpiperidin-4-yl)-1H-indazole-3-carboxamide
CID 10108057
1-(2,5-dimethylphenyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 46519529
3-(2-chlorophenyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-1H-pyrazole-5-carboxamide
CID 167769135
3-(2,4-dimethylphenyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]propanamide
CID 18149437
N-[1-(furan-2-carbonyl)piperidin-4-yl]-3-(4-methylphenyl)propanamide
CID 18154917
2-[[1-(furan-2-carbonyl)piperidin-4-yl]carbamoyl]benzoic acid
CID 113083174
(5-methyl-1H-indazol-3-yl)-morpholin-4-ylmethanone
CID 78869833
N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 134000227
ethyl 4-(1H-indazole-3-carbonylamino)piperidine-1-carboxylate
CID 42477818

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide?
The IUPAC name of N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide (CID 78868846) is N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide?
The canonical SMILES for N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide is Cc1ccc2[nH]nc(C(=O)NC3CCN(C(=O)c4ccco4)CC3)c2c1.
What is the InChIKey of N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide?
The InChIKey is NRTYEMPGODHTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-12-4-5-15-14(11-12)17(22-21-15)18(24)20-13-6-8-23(9-7-13)19(25)16-3-2-10-26-16/h2-5,10-11,13H,6-9H2,1H3,(H,20,24)(H,21,22).
What are the key properties of N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide?
N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide has a molecular weight of 352.39 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide is sourced from PubChem (CID 78868846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).