N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide

C15H23NO4 — CID 66168303

IUPACN-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
SMILESCC1CC1c1ccc(CCC(=O)NCC(C)(O)CO)o1
InChIInChI=1S/C15H23NO4/c1-10-7-12(10)13-5-3-11(20-13)4-6-14(18)16-8-15(2,19)9-17/h3,5,10,12,17,19H,4,6-9H2,1-2H3,(H,16,18)
InChIKeyQFGYQIICYCRCPH-UHFFFAOYSA-N
MW281.35 g/mol
LogP1.20
Rot. Bonds7

About N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide

N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide (PubChem CID 66168303) has the molecular formula C15H23NO4 and a molecular weight of 281.35 g/mol. Its IUPAC name is N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide.

Molecular Properties

Compound NameN-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
PubChem CID66168303
Molecular FormulaC15H23NO4
Molecular Weight281.35 g/mol
Exact Mass281.16
IUPAC NameN-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
SMILESCC1CC1c1ccc(CCC(=O)NCC(C)(O)CO)o1
InChIInChI=1S/C15H23NO4/c1-10-7-12(10)13-5-3-11(20-13)4-6-14(18)16-8-15(2,19)9-17/h3,5,10,12,17,19H,4,6-9H2,1-2H3,(H,16,18)
InChIKeyQFGYQIICYCRCPH-UHFFFAOYSA-N
XLogP1.20
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.35
LogP ≤ 51.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-2-methylpentyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
CID 103713210
4-[3-[5-(2-methylcyclopropyl)furan-2-yl]propanoylamino]butanamide
CID 56812725
N-methoxy-3-[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]propanamide
CID 94502622
N-(5-hydroxy-4-methylpentyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
CID 103862369
methyl 3-[5-(2-methylcyclopropyl)furan-2-yl]propanoate
CID 112723028
N-(4-hydroxy-3-methylbutan-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
CID 115771031
N-(3-ethoxypropyl)-3-[5-[(1S,2S)-2-methylcyclopropyl]furan-2-yl]propanamide
CID 94017148
N-butan-2-yl-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
CID 47014175
3-[5-(2-methylcyclopropyl)furan-2-yl]-N-(2,2,2-trifluoroethoxy)propanamide
CID 81343521
methyl 4-[[3-[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]propanoylamino]methyl]benzoate
CID 41237032
N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
CID 47014181
3-[5-[(1S,2S)-2-methylcyclopropyl]furan-2-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide
CID 94016882

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide?
The IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide (CID 66168303) is N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide.
What is the SMILES notation for N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide?
The canonical SMILES for N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide is CC1CC1c1ccc(CCC(=O)NCC(C)(O)CO)o1.
What is the InChIKey of N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide?
The InChIKey is QFGYQIICYCRCPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO4/c1-10-7-12(10)13-5-3-11(20-13)4-6-14(18)16-8-15(2,19)9-17/h3,5,10,12,17,19H,4,6-9H2,1-2H3,(H,16,18).
What are the key properties of N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide?
N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide has a molecular weight of 281.35 g/mol, XLogP of 1.20, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroxy-2-methylpropyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide is sourced from PubChem (CID 66168303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).