O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride

C10H14ClNO — CID 127038891

IUPACO-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride
SMILESCl.NOC(c1ccccc1)C1CC1
InChIInChI=1S/C10H13NO.ClH/c11-12-10(9-6-7-9)8-4-2-1-3-5-8;/h1-5,9-10H,6-7,11H2;1H
InChIKeyRCAFSRJZYKMNIN-UHFFFAOYSA-N
MW199.68 g/mol
LogP2.45
Rot. Bonds3

About O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride

O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride (PubChem CID 127038891) has the molecular formula C10H14ClNO and a molecular weight of 199.68 g/mol. Its IUPAC name is O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride.

Molecular Properties

Compound NameO-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride
PubChem CID127038891
Molecular FormulaC10H14ClNO
Molecular Weight199.68 g/mol
Exact Mass199.08
IUPAC NameO-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride
SMILESCl.NOC(c1ccccc1)C1CC1
InChIInChI=1S/C10H13NO.ClH/c11-12-10(9-6-7-9)8-4-2-1-3-5-8;/h1-5,9-10H,6-7,11H2;1H
InChIKeyRCAFSRJZYKMNIN-UHFFFAOYSA-N
XLogP2.45
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.68
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

O-[cyclopropyl-(3-methylphenyl)methyl]hydroxylamine
CID 143610202
2-cyclopropyl-2-phenylethanamine;hydrochloride
CID 57365234
[cyclopropyl(phenyl)methyl] N,N-di(propan-2-yl)carbamate
CID 154718412
[cyclohexyl(methylsulfanyloxy)methyl]benzene
CID 146296998
[bromo-[4-[bromo(phenyl)methyl]cyclohexyl]methyl]benzene
CID 126511399
[cyclopropyl(phenyl)methyl]hydrazine
CID 53403097
2-amino-1-cyclopropyl-2-phenylethanol
CID 62720038
[cyclohexyl(cyclopropylmethoxy)methyl]benzene
CID 145412407
1-cyclopropyl-N-[cyclopropyl(phenyl)methyl]-1-phenylmethanamine
CID 61312190
[cyclohexyl(propoxy)methyl]benzene
CID 155279791
methyl 2-cyclopropyl-2-phenylacetate
CID 82075532
[cyclopropyl-(4-phenylphenyl)methyl] acetate
CID 540182

Frequently Asked Questions

What is the IUPAC name of O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride?
The IUPAC name of O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride (CID 127038891) is O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride.
What is the SMILES notation for O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride?
The canonical SMILES for O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride is Cl.NOC(c1ccccc1)C1CC1.
What is the InChIKey of O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride?
The InChIKey is RCAFSRJZYKMNIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO.ClH/c11-12-10(9-6-7-9)8-4-2-1-3-5-8;/h1-5,9-10H,6-7,11H2;1H.
What are the key properties of O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride?
O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride has a molecular weight of 199.68 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-[cyclopropyl(phenyl)methyl]hydroxylamine;hydrochloride is sourced from PubChem (CID 127038891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).