N-(3-hydroxypropyl)furan-3-carboxamide

C8H11NO3 — CID 16729503

IUPACN-(3-hydroxypropyl)furan-3-carboxamide
SMILESO=C(NCCCO)c1ccoc1
InChIInChI=1S/C8H11NO3/c10-4-1-3-9-8(11)7-2-5-12-6-7/h2,5-6,10H,1,3-4H2,(H,9,11)
InChIKeyVDECSVBZYGNKLY-UHFFFAOYSA-N
MW169.18 g/mol
LogP0.39
Rot. Bonds4

About N-(3-hydroxypropyl)furan-3-carboxamide

N-(3-hydroxypropyl)furan-3-carboxamide (PubChem CID 16729503) has the molecular formula C8H11NO3 and a molecular weight of 169.18 g/mol. Its IUPAC name is N-(3-hydroxypropyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxypropyl)furan-3-carboxamide
PubChem CID16729503
Molecular FormulaC8H11NO3
Molecular Weight169.18 g/mol
Exact Mass169.07
IUPAC NameN-(3-hydroxypropyl)furan-3-carboxamide
SMILESO=C(NCCCO)c1ccoc1
InChIInChI=1S/C8H11NO3/c10-4-1-3-9-8(11)7-2-5-12-6-7/h2,5-6,10H,1,3-4H2,(H,9,11)
InChIKeyVDECSVBZYGNKLY-UHFFFAOYSA-N
XLogP0.39
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl(furan-3-yl)methanone
CID 24945123
3-Furoyl-l-leucylglycinamide
CID 166630178
3-Furancarboxamide, N,N-dimethyl-
CID 10820597
1-(Furan-3-carbonyl)piperidin-4-one
CID 24695810
1-(Furan-3-carbonyl)piperidin-4-amine
CID 16771508
Ethyl((furan-3-yl)methyl)amine
CID 23383580
3-[1-(Furan-3-YL)-N-(3-methoxypropyl)formamido]-N-(3-methylbutyl)propanamide
CID 3667145
3-[1-(Furan-3-YL)-N-(3-methylbutyl)formamido]-N-(3-methoxypropyl)propanamide
CID 4373963
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]furan-3-carboxamide
CID 25617383
N-(2-piperidin-1-ylethyl)furan-3-carboxamide
CID 45823667
N-(2-morpholin-4-ylpropyl)furan-3-carboxamide
CID 45878800
N-(2-oxo-2-piperidin-1-ylethyl)furan-3-carboxamide
CID 45883933

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxypropyl)furan-3-carboxamide?
The IUPAC name of N-(3-hydroxypropyl)furan-3-carboxamide (CID 16729503) is N-(3-hydroxypropyl)furan-3-carboxamide.
What is the SMILES notation for N-(3-hydroxypropyl)furan-3-carboxamide?
The canonical SMILES for N-(3-hydroxypropyl)furan-3-carboxamide is O=C(NCCCO)c1ccoc1.
What is the InChIKey of N-(3-hydroxypropyl)furan-3-carboxamide?
The InChIKey is VDECSVBZYGNKLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3/c10-4-1-3-9-8(11)7-2-5-12-6-7/h2,5-6,10H,1,3-4H2,(H,9,11).
What are the key properties of N-(3-hydroxypropyl)furan-3-carboxamide?
N-(3-hydroxypropyl)furan-3-carboxamide has a molecular weight of 169.18 g/mol, XLogP of 0.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxypropyl)furan-3-carboxamide is sourced from PubChem (CID 16729503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).