N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine

C14H25NO — CID 155617647

IUPACN-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine
SMILESC=C(C)C(C)(C)C(CC1CCCCC1)=NO
InChIInChI=1S/C14H25NO/c1-11(2)14(3,4)13(15-16)10-12-8-6-5-7-9-12/h12,16H,1,5-10H2,2-4H3
InChIKeyXIVQWLJFXNZRRA-UHFFFAOYSA-N
MW223.36 g/mol
LogP4.39
Rot. Bonds4

About N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine

N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine (PubChem CID 155617647) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine
PubChem CID155617647
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC NameN-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine
SMILESC=C(C)C(C)(C)C(CC1CCCCC1)=NO
InChIInChI=1S/C14H25NO/c1-11(2)14(3,4)13(15-16)10-12-8-6-5-7-9-12/h12,16H,1,5-10H2,2-4H3
InChIKeyXIVQWLJFXNZRRA-UHFFFAOYSA-N
XLogP4.39
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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

(NE)-N-(1-cyclohexyl-3,3,4-trimethylpentan-2-ylidene)hydroxylamine
CID 138580671
(NE)-N-(1-cyclohexyl-2,2,3-trimethylbut-3-enylidene)hydroxylamine
CID 138580980
N-(1-cyclopentylpropan-2-ylidene)hydroxylamine
CID 131143406
2-cyclohexyl-N'-hydroxy-N-methyl-N-[(2-methylpropan-2-yl)oxy]ethanimidamide
CID 156545784
1-cyclohexadecylpropan-2-one
CID 175123721
2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene
CID 143356436
prop-1-en-2-yl 2-cyclohexylacetate
CID 57350090
1-cyclohexyl-5-methylhex-5-en-2-one
CID 58107373
N-(cycloheptylmethyl)-2-methylprop-2-en-1-amine
CID 114615888
(3E)-1-cyclohexyl-6-(cyclohexylamino)-3,5,5-trimethylhepta-3,6-dien-2-one
CID 135138744
N-(2-cyclohexylethyl)prop-1-en-2-amine
CID 143355441
N-(2-cyclohexylethyl)-2-methylprop-2-enamide
CID 23044860

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine?
The IUPAC name of N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine (CID 155617647) is N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine.
What is the SMILES notation for N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine?
The canonical SMILES for N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine is C=C(C)C(C)(C)C(CC1CCCCC1)=NO.
What is the InChIKey of N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine?
The InChIKey is XIVQWLJFXNZRRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-11(2)14(3,4)13(15-16)10-12-8-6-5-7-9-12/h12,16H,1,5-10H2,2-4H3.
What are the key properties of N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine?
N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine has a molecular weight of 223.36 g/mol, XLogP of 4.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexyl-3,3,4-trimethylpent-4-en-2-ylidene)hydroxylamine is sourced from PubChem (CID 155617647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).