N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide

C11H17NO3 — CID 111447081

IUPACN-(4-hydroxy-2-methylpentyl)furan-3-carboxamide
SMILESCC(O)CC(C)CNC(=O)c1ccoc1
InChIInChI=1S/C11H17NO3/c1-8(5-9(2)13)6-12-11(14)10-3-4-15-7-10/h3-4,7-9,13H,5-6H2,1-2H3,(H,12,14)
InChIKeyHHCVTMOJIFRRJH-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.42
Rot. Bonds5

About N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide

N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide (PubChem CID 111447081) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxy-2-methylpentyl)furan-3-carboxamide
PubChem CID111447081
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC NameN-(4-hydroxy-2-methylpentyl)furan-3-carboxamide
SMILESCC(O)CC(C)CNC(=O)c1ccoc1
InChIInChI=1S/C11H17NO3/c1-8(5-9(2)13)6-12-11(14)10-3-4-15-7-10/h3-4,7-9,13H,5-6H2,1-2H3,(H,12,14)
InChIKeyHHCVTMOJIFRRJH-UHFFFAOYSA-N
XLogP1.42
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromo-4-methylpentyl)furan-3-carboxamide
CID 107157639
N-[2-(methylamino)propyl]furan-3-carboxamide
CID 103512728
N-(3-amino-3-hydroxyimino-2-methylpropyl)furan-3-carboxamide
CID 76952612
N-(2-cyclopropyl-2-hydroxyethyl)furan-3-carboxamide
CID 63294562
N-(4-hydroxy-2-methylpentyl)furan-2-carboxamide
CID 111447853
N-(3-bromobutyl)furan-3-carboxamide
CID 114312390
N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide
CID 111426324
N-(2-anilino-3-methylbutyl)furan-3-carboxamide
CID 47142406
4-(difluoromethoxy)-N-(4-hydroxy-2-methylpentyl)benzamide
CID 111447534
4-fluoro-N-(4-hydroxy-2-methylpentyl)-3-methylbenzamide
CID 111447266
3-(furan-3-carbonylamino)-2-phenylpropanoic acid
CID 62883834
N-(4-hydroxy-2-methylpentyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 111540039

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide?
The IUPAC name of N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide (CID 111447081) is N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide.
What is the SMILES notation for N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide?
The canonical SMILES for N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide is CC(O)CC(C)CNC(=O)c1ccoc1.
What is the InChIKey of N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide?
The InChIKey is HHCVTMOJIFRRJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-8(5-9(2)13)6-12-11(14)10-3-4-15-7-10/h3-4,7-9,13H,5-6H2,1-2H3,(H,12,14).
What are the key properties of N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide?
N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide has a molecular weight of 211.26 g/mol, XLogP of 1.42, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide is sourced from PubChem (CID 111447081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).