[(5-methylcyclononyl)amino]methanol

C11H23NO — CID 155469542

IUPAC[(5-methylcyclononyl)amino]methanol
SMILESCC1CCCCC(NCO)CCC1
InChIInChI=1S/C11H23NO/c1-10-5-2-3-7-11(12-9-13)8-4-6-10/h10-13H,2-9H2,1H3
InChIKeyWVEXPVOPTCMHKS-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.27
Rot. Bonds2

About [(5-methylcyclononyl)amino]methanol

[(5-methylcyclononyl)amino]methanol (PubChem CID 155469542) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is [(5-methylcyclononyl)amino]methanol.

Molecular Properties

Compound Name[(5-methylcyclononyl)amino]methanol
PubChem CID155469542
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name[(5-methylcyclononyl)amino]methanol
SMILESCC1CCCCC(NCO)CCC1
InChIInChI=1S/C11H23NO/c1-10-5-2-3-7-11(12-9-13)8-4-6-10/h10-13H,2-9H2,1H3
InChIKeyWVEXPVOPTCMHKS-UHFFFAOYSA-N
XLogP2.27
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-methyl-3-[(4-methylcycloheptyl)amino]propan-1-ol
CID 65079742
methylcyclobutane;tetrakis(methylcyclopentane)
CID 160836928
2-(cyclopentylamino)-N-methyl-N-(3-methylcyclohexyl)acetamide
CID 54948955
1-(cyclobutylamino)propan-2-one
CID 21335373
N-(cyclobutylmethyl)-4-methylcycloheptan-1-amine
CID 65081336
N-cyclohexyl-2-[(3-methylcyclohexyl)amino]acetamide
CID 43317870
N-cyclopentyl-4-methylcycloheptan-1-amine
CID 65081210
methylcyclopentane
CID 7296
1,5,9,13,17,21-hexamethylcyclotetracosane
CID 164675975
N-[(2-aminocyclohexyl)methyl]-4-methylcycloheptan-1-amine
CID 114100509
N-(2,3-dichloroprop-2-enyl)-3-methylcyclohexan-1-amine
CID 79167631
2-(cyclohexylamino)-N-propan-2-ylacetamide
CID 28565007

Frequently Asked Questions

What is the IUPAC name of [(5-methylcyclononyl)amino]methanol?
The IUPAC name of [(5-methylcyclononyl)amino]methanol (CID 155469542) is [(5-methylcyclononyl)amino]methanol.
What is the SMILES notation for [(5-methylcyclononyl)amino]methanol?
The canonical SMILES for [(5-methylcyclononyl)amino]methanol is CC1CCCCC(NCO)CCC1.
What is the InChIKey of [(5-methylcyclononyl)amino]methanol?
The InChIKey is WVEXPVOPTCMHKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-10-5-2-3-7-11(12-9-13)8-4-6-10/h10-13H,2-9H2,1H3.
What are the key properties of [(5-methylcyclononyl)amino]methanol?
[(5-methylcyclononyl)amino]methanol has a molecular weight of 185.31 g/mol, XLogP of 2.27, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-methylcyclononyl)amino]methanol is sourced from PubChem (CID 155469542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).