N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine

C10H11NO — CID 73116354

IUPACN-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine
SMILESC=C(C)C(=NO)c1ccccc1
InChIInChI=1S/C10H11NO/c1-8(2)10(11-12)9-6-4-3-5-7-9/h3-7,12H,1H2,2H3
InChIKeyAWVHHGRZSKKNML-UHFFFAOYSA-N
MW161.20 g/mol
LogP2.44
Rot. Bonds2

About N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine

N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine (PubChem CID 73116354) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine.

Molecular Properties

Compound NameN-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine
PubChem CID73116354
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC NameN-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine
SMILESC=C(C)C(=NO)c1ccccc1
InChIInChI=1S/C10H11NO/c1-8(2)10(11-12)9-6-4-3-5-7-9/h3-7,12H,1H2,2H3
InChIKeyAWVHHGRZSKKNML-UHFFFAOYSA-N
XLogP2.44
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2E,3E)-2,3-bis(hydroxyimino)-3-phenylpropanenitrile
CID 136857277
prop-1-en-2-ylbenzene;silane
CID 174724970
ethane;tris(prop-1-en-2-ylbenzene)
CID 161299444
N,3,4-trimethyl-2-methylidene-1-phenylpent-3-en-1-imine
CID 123311258
N-(2-hydrazinylidene-3,3-dimethyl-1-phenylbutylidene)hydroxylamine
CID 135410624
dilithium;hydride;tetrakis(prop-1-en-2-ylbenzene)
CID 173210084
bis(diphenylmethanone);2-methylprop-2-enoic acid
CID 175044660
ethyl (2Z)-2-hydroxyimino-2-phenylacetate
CID 15075005
(1-hydrazinylidene-1-phenylpropan-2-ylidene)hydrazine
CID 71413419
(NZ)-N-[(4-methylphenyl)-phenylmethylidene]hydroxylamine
CID 6303063
CID 177403611
CID 177403611
3-phenylbuta-1,3-dien-2-ylbenzene;[(Z)-3-phenylbut-2-en-2-yl]benzene
CID 143250660

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine?
The IUPAC name of N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine (CID 73116354) is N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine.
What is the SMILES notation for N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine?
The canonical SMILES for N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine is C=C(C)C(=NO)c1ccccc1.
What is the InChIKey of N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine?
The InChIKey is AWVHHGRZSKKNML-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c1-8(2)10(11-12)9-6-4-3-5-7-9/h3-7,12H,1H2,2H3.
What are the key properties of N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine?
N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine has a molecular weight of 161.20 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-phenylprop-2-enylidene)hydroxylamine is sourced from PubChem (CID 73116354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).