5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide

C15H23NO3 — CID 79191839

IUPAC5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide
SMILESCC1CC1c1ccc(CN(C)C(=O)CCCCO)o1
InChIInChI=1S/C15H23NO3/c1-11-9-13(11)14-7-6-12(19-14)10-16(2)15(18)5-3-4-8-17/h6-7,11,13,17H,3-5,8-10H2,1-2H3
InChIKeyPGFXIHUCJLBGSI-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.52
Rot. Bonds7

About 5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide

5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide (PubChem CID 79191839) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide.

Molecular Properties

Compound Name5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide
PubChem CID79191839
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide
SMILESCC1CC1c1ccc(CN(C)C(=O)CCCCO)o1
InChIInChI=1S/C15H23NO3/c1-11-9-13(11)14-7-6-12(19-14)10-16(2)15(18)5-3-4-8-17/h6-7,11,13,17H,3-5,8-10H2,1-2H3
InChIKeyPGFXIHUCJLBGSI-UHFFFAOYSA-N
XLogP2.52
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3,3,3-trifluoro-N-methyl-N-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]propanamide
CID 94001598
3,3,3-trifluoro-N-methyl-N-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]propanamide
CID 94001595
2-hydroxyethyl N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]carbamate
CID 79345361
2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide
CID 54869738
3-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide
CID 17472604
N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide
CID 94150490
4-bromo-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]benzamide
CID 60697653
4-[[methyl-[3-[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]propanoyl]amino]methyl]benzamide
CID 94002601
methyl 3-[methyl-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]amino]propanoate
CID 94489479
2-amino-N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide
CID 60939227
N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide
CID 63122159
N,2-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide
CID 106739295

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide?
The IUPAC name of 5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide (CID 79191839) is 5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide.
What is the SMILES notation for 5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide?
The canonical SMILES for 5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide is CC1CC1c1ccc(CN(C)C(=O)CCCCO)o1.
What is the InChIKey of 5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide?
The InChIKey is PGFXIHUCJLBGSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-11-9-13(11)14-7-6-12(19-14)10-16(2)15(18)5-3-4-8-17/h6-7,11,13,17H,3-5,8-10H2,1-2H3.
What are the key properties of 5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide?
5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide has a molecular weight of 265.35 g/mol, XLogP of 2.52, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide is sourced from PubChem (CID 79191839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).