2-[1-(furan-2-yl)propylamino]ethylurea

C10H17N3O2 — CID 83109971

IUPAC2-[1-(furan-2-yl)propylamino]ethylurea
SMILESCCC(NCCNC(N)=O)c1ccco1
InChIInChI=1S/C10H17N3O2/c1-2-8(9-4-3-7-15-9)12-5-6-13-10(11)14/h3-4,7-8,12H,2,5-6H2,1H3,(H3,11,13,14)
InChIKeyJCNYMRPEPZXYRI-UHFFFAOYSA-N
MW211.27 g/mol
LogP0.99
Rot. Bonds6

About 2-[1-(furan-2-yl)propylamino]ethylurea

2-[1-(furan-2-yl)propylamino]ethylurea (PubChem CID 83109971) has the molecular formula C10H17N3O2 and a molecular weight of 211.27 g/mol. Its IUPAC name is 2-[1-(furan-2-yl)propylamino]ethylurea.

Molecular Properties

Compound Name2-[1-(furan-2-yl)propylamino]ethylurea
PubChem CID83109971
Molecular FormulaC10H17N3O2
Molecular Weight211.27 g/mol
Exact Mass211.13
IUPAC Name2-[1-(furan-2-yl)propylamino]ethylurea
SMILESCCC(NCCNC(N)=O)c1ccco1
InChIInChI=1S/C10H17N3O2/c1-2-8(9-4-3-7-15-9)12-5-6-13-10(11)14/h3-4,7-8,12H,2,5-6H2,1H3,(H3,11,13,14)
InChIKeyJCNYMRPEPZXYRI-UHFFFAOYSA-N
XLogP0.99
TPSA80.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[1-(furan-2-yl)propylamino]ethoxy]acetamide
CID 106235398
N'-[1-(furan-2-yl)propyl]ethane-1,2-diamine
CID 62633441
3-[1-(furan-2-yl)propylamino]-N-propan-2-ylpropanamide
CID 113409686
N'-[1-(furan-2-yl)propyl]butane-1,4-diamine
CID 62633443
2-[1-(4-hydroxyphenyl)propylamino]ethylurea
CID 83110517
1-(furan-2-yl)-N-(2-methoxyethyl)propan-1-amine
CID 62632133
2-[1-(furan-2-yl)propylamino]-N-propan-2-ylacetamide
CID 62633589
2-[2-[1-(furan-2-yl)propylamino]phenyl]acetamide
CID 62632896
N-ethyl-N-[3-[1-(furan-2-yl)propylamino]propyl]methanesulfonamide
CID 55098017
tert-butyl 2-[1-(furan-2-yl)propylamino]acetate
CID 81463030
N-(2-cyclopentylethyl)-1-(furan-2-yl)propan-1-amine
CID 62633625
N-[2-(4-chlorophenyl)ethyl]-1-(furan-2-yl)propan-1-amine
CID 55097343

Frequently Asked Questions

What is the IUPAC name of 2-[1-(furan-2-yl)propylamino]ethylurea?
The IUPAC name of 2-[1-(furan-2-yl)propylamino]ethylurea (CID 83109971) is 2-[1-(furan-2-yl)propylamino]ethylurea.
What is the SMILES notation for 2-[1-(furan-2-yl)propylamino]ethylurea?
The canonical SMILES for 2-[1-(furan-2-yl)propylamino]ethylurea is CCC(NCCNC(N)=O)c1ccco1.
What is the InChIKey of 2-[1-(furan-2-yl)propylamino]ethylurea?
The InChIKey is JCNYMRPEPZXYRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-2-8(9-4-3-7-15-9)12-5-6-13-10(11)14/h3-4,7-8,12H,2,5-6H2,1H3,(H3,11,13,14).
What are the key properties of 2-[1-(furan-2-yl)propylamino]ethylurea?
2-[1-(furan-2-yl)propylamino]ethylurea has a molecular weight of 211.27 g/mol, XLogP of 0.99, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(furan-2-yl)propylamino]ethylurea is sourced from PubChem (CID 83109971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).