N,1-dimethyl-N-oxidocyclononan-1-amine

C11H22NO- — CID 163589699

IUPACN,1-dimethyl-N-oxidocyclononan-1-amine
SMILESCN([O-])C1(C)CCCCCCCC1
InChIInChI=1S/C11H22NO/c1-11(12(2)13)9-7-5-3-4-6-8-10-11/h3-10H2,1-2H3/q-1
InChIKeyLGCIJUGCZFOPCB-UHFFFAOYSA-N
MW184.30 g/mol
LogP3.31
Rot. Bonds1

About N,1-dimethyl-N-oxidocyclononan-1-amine

N,1-dimethyl-N-oxidocyclononan-1-amine (PubChem CID 163589699) has the molecular formula C11H22NO- and a molecular weight of 184.30 g/mol. Its IUPAC name is N,1-dimethyl-N-oxidocyclononan-1-amine.

Molecular Properties

Compound NameN,1-dimethyl-N-oxidocyclononan-1-amine
PubChem CID163589699
Molecular FormulaC11H22NO-
Molecular Weight184.30 g/mol
Exact Mass184.17
IUPAC NameN,1-dimethyl-N-oxidocyclononan-1-amine
SMILESCN([O-])C1(C)CCCCCCCC1
InChIInChI=1S/C11H22NO/c1-11(12(2)13)9-7-5-3-4-6-8-10-11/h3-10H2,1-2H3/q-1
InChIKeyLGCIJUGCZFOPCB-UHFFFAOYSA-N
XLogP3.31
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.30
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,1-dimethyl-N-(1-methylcyclooctyl)cyclononan-1-amine
CID 139400703
N-methoxy-1-methyl-N-oxidocyclohexan-1-amine
CID 163740605
N-methyl-N-(1-methylcyclohexyl)formamide
CID 175037555
1-butyl-N-methyl-N-oxidocyclohexan-1-amine
CID 122611001
1,1,7,7-tetramethylcyclopentadecane
CID 123360096
1,1-dimethylcyclononane
CID 59289773
N,N,3-trimethylpiperidin-3-amine
CID 117000006
N-methyl-N-(1-methylcyclohexyl)-4-nitroaniline
CID 126549261
N-methyl-N-(1-methylcyclopentyl)ethanesulfonamide
CID 130659156
1,1-dimethylcyclohexane;methane
CID 160770296
azane;1,1-dimethylcyclohexane
CID 90411117
methyl-(1-methylcyclobutyl)carbamic acid
CID 175139103

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-oxidocyclononan-1-amine?
The IUPAC name of N,1-dimethyl-N-oxidocyclononan-1-amine (CID 163589699) is N,1-dimethyl-N-oxidocyclononan-1-amine.
What is the SMILES notation for N,1-dimethyl-N-oxidocyclononan-1-amine?
The canonical SMILES for N,1-dimethyl-N-oxidocyclononan-1-amine is CN([O-])C1(C)CCCCCCCC1.
What is the InChIKey of N,1-dimethyl-N-oxidocyclononan-1-amine?
The InChIKey is LGCIJUGCZFOPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22NO/c1-11(12(2)13)9-7-5-3-4-6-8-10-11/h3-10H2,1-2H3/q-1.
What are the key properties of N,1-dimethyl-N-oxidocyclononan-1-amine?
N,1-dimethyl-N-oxidocyclononan-1-amine has a molecular weight of 184.30 g/mol, XLogP of 3.31, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-oxidocyclononan-1-amine is sourced from PubChem (CID 163589699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).