N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide

C19H24N2O4 — CID 111433258

IUPACN-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
SMILESO=C(NCC1(O)CCCCCC1)c1ccc(Cn2ccccc2=O)o1
InChIInChI=1S/C19H24N2O4/c22-17-7-3-6-12-21(17)13-15-8-9-16(25-15)18(23)20-14-19(24)10-4-1-2-5-11-19/h3,6-9,12,24H,1-2,4-5,10-11,13-14H2,(H,20,23)
InChIKeyQYDYWTUXBAKIGX-UHFFFAOYSA-N
MW344.41 g/mol
LogP2.30
Rot. Bonds5

About N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide

N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide (PubChem CID 111433258) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
PubChem CID111433258
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC NameN-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
SMILESO=C(NCC1(O)CCCCCC1)c1ccc(Cn2ccccc2=O)o1
InChIInChI=1S/C19H24N2O4/c22-17-7-3-6-12-21(17)13-15-8-9-16(25-15)18(23)20-14-19(24)10-4-1-2-5-11-19/h3,6-9,12,24H,1-2,4-5,10-11,13-14H2,(H,20,23)
InChIKeyQYDYWTUXBAKIGX-UHFFFAOYSA-N
XLogP2.30
TPSA84.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(2-oxo-1-pyridinyl)methyl]-N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide
CID 36598751
5-[(2-oxo-1-pyridinyl)methyl]-N-[(1-phenylcyclopropyl)methyl]furan-2-carboxamide
CID 33284170
N-(1-adamantylmethyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 38029532
5-ethyl-N-[(1-hydroxycyclohexyl)methyl]furan-2-carboxamide
CID 64868940
N-(2-methylpropyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 47141529
5-[(2-oxo-1-pyridinyl)methyl]-N-prop-2-enylfuran-2-carboxamide
CID 47141528
N-[2-(2-methylpropanoylamino)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 31344363
N-[(2R)-3-methylbutan-2-yl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 30597946
N-[(2S)-3-methylbutan-2-yl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 30597949
5-[(2-oxo-1-pyridinyl)methyl]-N-(2-piperidin-1-ylsulfonylphenyl)furan-2-carboxamide
CID 60549570
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 78839450
1-[(1-hydroxycycloheptyl)methyl]-3-[4-(2-oxo-1-pyridinyl)butyl]urea
CID 111426906

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The IUPAC name of N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide (CID 111433258) is N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The canonical SMILES for N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide is O=C(NCC1(O)CCCCCC1)c1ccc(Cn2ccccc2=O)o1.
What is the InChIKey of N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The InChIKey is QYDYWTUXBAKIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c22-17-7-3-6-12-21(17)13-15-8-9-16(25-15)18(23)20-14-19(24)10-4-1-2-5-11-19/h3,6-9,12,24H,1-2,4-5,10-11,13-14H2,(H,20,23).
What are the key properties of N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide has a molecular weight of 344.41 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycycloheptyl)methyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 111433258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).