1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea

C15H24N2O4 — CID 110892535

IUPAC1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea
SMILESO=C(NCCCOCc1ccco1)NC1CCC(O)CC1
InChIInChI=1S/C15H24N2O4/c18-13-6-4-12(5-7-13)17-15(19)16-8-2-9-20-11-14-3-1-10-21-14/h1,3,10,12-13,18H,2,4-9,11H2,(H2,16,17,19)
InChIKeyPBKNKJWPIBICOK-UHFFFAOYSA-N
MW296.37 g/mol
LogP1.79
Rot. Bonds7

About 1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea

1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea (PubChem CID 110892535) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is 1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea.

Molecular Properties

Compound Name1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea
PubChem CID110892535
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC Name1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea
SMILESO=C(NCCCOCc1ccco1)NC1CCC(O)CC1
InChIInChI=1S/C15H24N2O4/c18-13-6-4-12(5-7-13)17-15(19)16-8-2-9-20-11-14-3-1-10-21-14/h1,3,10,12-13,18H,2,4-9,11H2,(H2,16,17,19)
InChIKeyPBKNKJWPIBICOK-UHFFFAOYSA-N
XLogP1.79
TPSA83.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 51.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(1R,5S,6R)-7,7-dimethyl-2-oxabicyclo[3.2.0]heptan-6-yl]-3-[3-(furan-2-ylmethoxy)propyl]urea
CID 100893850
1-[(1R,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-3-[3-(furan-2-ylmethoxy)propyl]urea
CID 100836192
2-(azetidin-3-yl)-N-[3-(furan-2-ylmethoxy)propyl]acetamide
CID 64611617
1-(3,3-diphenylpropyl)-3-[3-(furan-2-ylmethoxy)propyl]urea
CID 31964425
1-[3-(furan-2-ylmethoxy)propyl]-3-(2-methylpropoxy)urea
CID 75431227
3-chloro-N-[3-(furan-2-ylmethoxy)propyl]propanamide
CID 61251673
3-amino-N-[3-(furan-2-ylmethoxy)propyl]-2,2-dimethylpropanamide
CID 113307628
3-amino-N-[3-(furan-2-ylmethoxy)propyl]cyclopentane-1-carboxamide
CID 66008372
4-(aminomethyl)-N-[3-(furan-2-ylmethoxy)propyl]cyclohexane-1-carboxamide
CID 79519433
N-[3-(furan-2-ylmethoxy)propyl]thiomorpholine-3-carboxamide
CID 82909429
1-(aminomethyl)-N-[3-(furan-2-ylmethoxy)propyl]cyclopropane-1-carboxamide
CID 113312924
1-[3-(furan-2-ylmethoxy)propyl]-3-pyridin-3-ylurea
CID 47126067

Frequently Asked Questions

What is the IUPAC name of 1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea?
The IUPAC name of 1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea (CID 110892535) is 1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea.
What is the SMILES notation for 1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea?
The canonical SMILES for 1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea is O=C(NCCCOCc1ccco1)NC1CCC(O)CC1.
What is the InChIKey of 1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea?
The InChIKey is PBKNKJWPIBICOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c18-13-6-4-12(5-7-13)17-15(19)16-8-2-9-20-11-14-3-1-10-21-14/h1,3,10,12-13,18H,2,4-9,11H2,(H2,16,17,19).
What are the key properties of 1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea?
1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea has a molecular weight of 296.37 g/mol, XLogP of 1.79, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(furan-2-ylmethoxy)propyl]-3-(4-hydroxycyclohexyl)urea is sourced from PubChem (CID 110892535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).