N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine

C10H19NO — CID 20651790

IUPACN-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine
SMILESCC1=CC(N(C)O)C(C)C(C)C1
InChIInChI=1S/C10H19NO/c1-7-5-8(2)9(3)10(6-7)11(4)12/h6,8-10,12H,5H2,1-4H3
InChIKeyYPNUNFWARRDACV-UHFFFAOYSA-N
MW169.27 g/mol
LogP2.30
Rot. Bonds1

About N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine

N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine (PubChem CID 20651790) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine.

Molecular Properties

Compound NameN-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine
PubChem CID20651790
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine
SMILESCC1=CC(N(C)O)C(C)C(C)C1
InChIInChI=1S/C10H19NO/c1-7-5-8(2)9(3)10(6-7)11(4)12/h6,8-10,12H,5H2,1-4H3
InChIKeyYPNUNFWARRDACV-UHFFFAOYSA-N
XLogP2.30
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,3,4,5-tetramethylcyclohexene
CID 12751050
N,N-dimethyl-1-[(1S,2S,6S)-2,4,6-trimethylcyclohex-3-en-1-yl]methanamine
CID 98157758
N,N-dimethyl-1-[(1R,2R,6R)-2,4,6-trimethylcyclohex-3-en-1-yl]methanamine
CID 40543075
(3S)-1,3-dimethylcyclobutene
CID 58737300
N-methyl-N-[[(1R,2S,6S)-2,4,6-trimethylcyclohex-3-en-1-yl]methyl]acetamide
CID 11898076
N-methyl-N-[[(1S,2R,6S)-2,4,6-trimethylcyclohex-3-en-1-yl]methyl]acetamide
CID 6945433
(3R,4S)-3-ethyl-1,4-dimethylcyclopentene
CID 163464724
N-[(1R,2R,6S)-2-hydroxy-4,6-dimethylcyclohex-3-en-1-yl]acetamide
CID 160561740
2-[[(1R,2S,6S)-2,4,6-trimethylcyclohex-3-en-1-yl]methyl-[[(1S,2S,6R)-2,4,6-trimethylcyclohex-3-en-1-yl]methyl]amino]ethanol
CID 98284061
(1R,2S,3S)-3,5-dimethylcyclohex-4-ene-1,2-dicarboxylic acid
CID 7071592
(1R,2R,6R)-2,4,6-trimethylcyclohex-3-ene-1-carbonitrile
CID 11899238
(1S,2S,6S)-2,4,6-trimethylcyclohex-3-ene-1-carbaldehyde
CID 7373245

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine?
The IUPAC name of N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine (CID 20651790) is N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine.
What is the SMILES notation for N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine?
The canonical SMILES for N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine is CC1=CC(N(C)O)C(C)C(C)C1.
What is the InChIKey of N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine?
The InChIKey is YPNUNFWARRDACV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-7-5-8(2)9(3)10(6-7)11(4)12/h6,8-10,12H,5H2,1-4H3.
What are the key properties of N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine?
N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine has a molecular weight of 169.27 g/mol, XLogP of 2.30, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3,5,6-trimethylcyclohex-2-en-1-yl)hydroxylamine is sourced from PubChem (CID 20651790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).