N-[3-(furan-2-yl)propyl]formamide

C8H11NO2 — CID 87322197

IUPACN-[3-(furan-2-yl)propyl]formamide
SMILESO=CNCCCc1ccco1
InChIInChI=1S/C8H11NO2/c10-7-9-5-1-3-8-4-2-6-11-8/h2,4,6-7H,1,3,5H2,(H,9,10)
InChIKeyNKMQOIQIEQRHNJ-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.96
Rot. Bonds5

About N-[3-(furan-2-yl)propyl]formamide

N-[3-(furan-2-yl)propyl]formamide (PubChem CID 87322197) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is N-[3-(furan-2-yl)propyl]formamide.

Molecular Properties

Compound NameN-[3-(furan-2-yl)propyl]formamide
PubChem CID87322197
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC NameN-[3-(furan-2-yl)propyl]formamide
SMILESO=CNCCCc1ccco1
InChIInChI=1S/C8H11NO2/c10-7-9-5-1-3-8-4-2-6-11-8/h2,4,6-7H,1,3,5H2,(H,9,10)
InChIKeyNKMQOIQIEQRHNJ-UHFFFAOYSA-N
XLogP0.96
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(furan-2-yl)butanal
CID 14455558
3-(furan-2-yl)-N-methylpropan-1-amine
CID 2772204
N,N'-bis(furan-2-ylmethyl)pentane-1,5-diamine
CID 170781680
2-[[1-carboxy-2-(furan-2-yl)ethyl]carbamoylamino]-6-formamidohexanoic acid
CID 146884780
N-(3-formamidopropyl)furan-2-carboxamide
CID 110461151
5-(furan-2-yl)pentyl formate
CID 87851919
N'-[2-(furan-2-yl)ethyl]hexane-1,6-diamine
CID 61470977
6-(furan-2-yl)hexyl formate
CID 87852506
3-(furan-2-yl)propane-1-thiol
CID 12549643
2-(3-chloropropyl)furan
CID 12549641
7-(furan-2-yl)hept-2-ynal
CID 102105207
(E)-4-chloro-N-[2-(furan-2-yl)ethyl]but-2-en-1-amine
CID 81429403

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-yl)propyl]formamide?
The IUPAC name of N-[3-(furan-2-yl)propyl]formamide (CID 87322197) is N-[3-(furan-2-yl)propyl]formamide.
What is the SMILES notation for N-[3-(furan-2-yl)propyl]formamide?
The canonical SMILES for N-[3-(furan-2-yl)propyl]formamide is O=CNCCCc1ccco1.
What is the InChIKey of N-[3-(furan-2-yl)propyl]formamide?
The InChIKey is NKMQOIQIEQRHNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c10-7-9-5-1-3-8-4-2-6-11-8/h2,4,6-7H,1,3,5H2,(H,9,10).
What are the key properties of N-[3-(furan-2-yl)propyl]formamide?
N-[3-(furan-2-yl)propyl]formamide has a molecular weight of 153.18 g/mol, XLogP of 0.96, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-yl)propyl]formamide is sourced from PubChem (CID 87322197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).