1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea

C19H22N2O3 — CID 19894164

IUPAC1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea
SMILESCC(Oc1ccc(C2CC2CN(O)C(N)=O)cc1)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-13(14-5-3-2-4-6-14)24-17-9-7-15(8-10-17)18-11-16(18)12-21(23)19(20)22/h2-10,13,16,18,23H,11-12H2,1H3,(H2,20,22)
InChIKeyVKEBWUJHIFKHQZ-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.70
Rot. Bonds6

About 1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea

1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea (PubChem CID 19894164) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea.

Molecular Properties

Compound Name1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea
PubChem CID19894164
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea
SMILESCC(Oc1ccc(C2CC2CN(O)C(N)=O)cc1)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-13(14-5-3-2-4-6-14)24-17-9-7-15(8-10-17)18-11-16(18)12-21(23)19(20)22/h2-10,13,16,18,23H,11-12H2,1H3,(H2,20,22)
InChIKeyVKEBWUJHIFKHQZ-UHFFFAOYSA-N
XLogP3.70
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]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-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea
CID 15015094
1-hydroxy-1-[(2-pyridin-4-ylcyclopropyl)methyl]urea
CID 19894152
1-[[2-[3,4-bis(phenylmethoxy)phenyl]cyclopropyl]methyl]-1-hydroxyurea
CID 57015699
2-[hydroxy-[1-[4-(1-phenylethoxy)phenyl]ethyl]amino]acetamide
CID 88651998
1-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopropyl]methyl]-1-hydroxyurea
CID 19894244
1-hydroxy-1-[[(1R,2R)-2-[3-(3-methylphenoxy)phenyl]cyclopropyl]methyl]urea
CID 22844514
1-[[2-(furan-3-yl)cyclopropyl]methyl]-1-hydroxyurea
CID 19894214
(2S)-2-[[4-(1-phenylethoxy)phenyl]methylamino]propanamide
CID 70078273
2-chloro-N-hydroxy-N-[(2-phenylcyclopropyl)methyl]acetamide
CID 22405882
4-[(1S)-1-phenylethoxy]benzoic acid
CID 28604848
N,N-dimethyl-1-[(1S)-2-phenylcyclopropyl]methanamine;1-hydroxy-1-[(2-phenylcyclopropyl)methyl]urea;2-phenylcyclopropane-1-carboxylic acid;(2-phenylcyclopropyl)methanol;N-[[(1S)-2-phenylcyclopropyl]methyl]hydroxylamine
CID 157397339
sodium;hydride;N-hydroxy-N-[1-[4-(1-phenylethoxy)phenyl]ethyl]acetamide
CID 173366531

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea?
The IUPAC name of 1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea (CID 19894164) is 1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea.
What is the SMILES notation for 1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea?
The canonical SMILES for 1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea is CC(Oc1ccc(C2CC2CN(O)C(N)=O)cc1)c1ccccc1.
What is the InChIKey of 1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea?
The InChIKey is VKEBWUJHIFKHQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-13(14-5-3-2-4-6-14)24-17-9-7-15(8-10-17)18-11-16(18)12-21(23)19(20)22/h2-10,13,16,18,23H,11-12H2,1H3,(H2,20,22).
What are the key properties of 1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea?
1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea has a molecular weight of 326.40 g/mol, XLogP of 3.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea is sourced from PubChem (CID 19894164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).