1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea

C11H14N2O2 — CID 15015094

IUPAC1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea
SMILESNC(=O)N(O)C[C@@H]1C[C@H]1c1ccccc1
InChIInChI=1S/C11H14N2O2/c12-11(14)13(15)7-9-6-10(9)8-4-2-1-3-5-8/h1-5,9-10,15H,6-7H2,(H2,12,14)/t9-,10-/m0/s1
InChIKeyFRIAXOPYVDCVOF-UWVGGRQHSA-N
MW206.25 g/mol
LogP1.56
Rot. Bonds3

About 1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea

1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea (PubChem CID 15015094) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is 1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea.

Molecular Properties

Compound Name1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea
PubChem CID15015094
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea
SMILESNC(=O)N(O)C[C@@H]1C[C@H]1c1ccccc1
InChIInChI=1S/C11H14N2O2/c12-11(14)13(15)7-9-6-10(9)8-4-2-1-3-5-8/h1-5,9-10,15H,6-7H2,(H2,12,14)/t9-,10-/m0/s1
InChIKeyFRIAXOPYVDCVOF-UWVGGRQHSA-N
XLogP1.56
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-hydroxy-1-[(2-pyridin-4-ylcyclopropyl)methyl]urea
CID 19894152
2-chloro-N-hydroxy-N-[(2-phenylcyclopropyl)methyl]acetamide
CID 22405882
1-hydroxy-1-[[2-[4-(1-phenylethoxy)phenyl]cyclopropyl]methyl]urea
CID 19894164
1-[[2-(furan-3-yl)cyclopropyl]methyl]-1-hydroxyurea
CID 19894214
1-hydroxy-1-[[2-[3-(4-hydroxyphenyl)phenyl]cyclopropyl]methyl]urea
CID 57209733
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
1-[[2-[3,4-bis(phenylmethoxy)phenyl]cyclopropyl]methyl]-1-hydroxyurea
CID 57015699
1-hydroxy-1-[[(1R,2R)-2-[3-(3-methylphenoxy)phenyl]cyclopropyl]methyl]urea
CID 22844514
1-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopropyl]methyl]-1-hydroxyurea
CID 19894244
1-[[(1R,2R)-2-(1-benzofuran-2-yl)cyclopropyl]methyl]-1-hydroxyurea
CID 18646331
1-hydroxy-1-[(2-quinolin-1-ium-4-ylcyclopropyl)methyl]urea
CID 3692752
1-hydroxy-1-[[(1R,2R)-2-(5-methylthiophen-2-yl)cyclopropyl]methyl]urea
CID 18646413

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea?
The IUPAC name of 1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea (CID 15015094) is 1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea.
What is the SMILES notation for 1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea?
The canonical SMILES for 1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea is NC(=O)N(O)C[C@@H]1C[C@H]1c1ccccc1.
What is the InChIKey of 1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea?
The InChIKey is FRIAXOPYVDCVOF-UWVGGRQHSA-N. The full InChI is InChI=1S/C11H14N2O2/c12-11(14)13(15)7-9-6-10(9)8-4-2-1-3-5-8/h1-5,9-10,15H,6-7H2,(H2,12,14)/t9-,10-/m0/s1.
What are the key properties of 1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea?
1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea has a molecular weight of 206.25 g/mol, XLogP of 1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea is sourced from PubChem (CID 15015094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).