N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide

C18H20N2O3 — CID 6459657

IUPACN-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide
SMILESCc1ccc(C(=O)N2CCCCC2)cc1NC(=O)c1ccco1
InChIInChI=1S/C18H20N2O3/c1-13-7-8-14(18(22)20-9-3-2-4-10-20)12-15(13)19-17(21)16-6-5-11-23-16/h5-8,11-12H,2-4,9-10H2,1H3,(H,19,21)
InChIKeyMFTUUEZOBCACKA-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.47
Rot. Bonds3

About N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide

N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide (PubChem CID 6459657) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide
PubChem CID6459657
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide
SMILESCc1ccc(C(=O)N2CCCCC2)cc1NC(=O)c1ccco1
InChIInChI=1S/C18H20N2O3/c1-13-7-8-14(18(22)20-9-3-2-4-10-20)12-15(13)19-17(21)16-6-5-11-23-16/h5-8,11-12H,2-4,9-10H2,1H3,(H,19,21)
InChIKeyMFTUUEZOBCACKA-UHFFFAOYSA-N
XLogP3.47
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-[4-(aminomethyl)piperidine-1-carbonyl]-2-methylphenyl]furan-2-carboxamide
CID 119422876
N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide
CID 18157076
N-[5-(4-benzamidopiperidine-1-carbonyl)-2-methylphenyl]furan-2-carboxamide
CID 37019545
N-[5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-2-methylphenyl]furan-2-carboxamide
CID 9154613
N-[5-[4-(3,4-dichlorobenzoyl)piperidine-1-carbonyl]-2-methylphenyl]furan-2-carboxamide
CID 55956380
N-[2-methyl-5-[3-(methylaminomethyl)piperidine-1-carbonyl]phenyl]furan-2-carboxamide
CID 119394743
N-[5-[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole-5-carbonyl]-2-methylphenyl]furan-2-carboxamide
CID 120659344
N-[5-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-2-methylphenyl]furan-2-carboxamide
CID 17454978
N-[4-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide
CID 9035306
N-[2-methyl-5-[2-(4-methylphenyl)pyrrolidine-1-carbonyl]phenyl]furan-2-carboxamide
CID 55550875
N-[2-methyl-5-(2-methylpiperazine-1-carbonyl)phenyl]furan-2-carboxamide
CID 119469960
N-[4-[4-(3-fluoro-4-methylbenzoyl)piperazine-1-carbonyl]phenyl]furan-2-carboxamide
CID 55959407

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide (CID 6459657) is N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide is Cc1ccc(C(=O)N2CCCCC2)cc1NC(=O)c1ccco1.
What is the InChIKey of N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide?
The InChIKey is MFTUUEZOBCACKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-13-7-8-14(18(22)20-9-3-2-4-10-20)12-15(13)19-17(21)16-6-5-11-23-16/h5-8,11-12H,2-4,9-10H2,1H3,(H,19,21).
What are the key properties of N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide?
N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 6459657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).