methanol;N-(2-methylpropyl)cyclopentanamine

C10H23NO — CID 166557930

IUPACmethanol;N-(2-methylpropyl)cyclopentanamine
SMILESCC(C)CNC1CCCC1.CO
InChIInChI=1S/C9H19N.CH4O/c1-8(2)7-10-9-5-3-4-6-9;1-2/h8-10H,3-7H2,1-2H3;2H,1H3
InChIKeyKUBYJVBFGSUVFT-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.78
Rot. Bonds3

About methanol;N-(2-methylpropyl)cyclopentanamine

methanol;N-(2-methylpropyl)cyclopentanamine (PubChem CID 166557930) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is methanol;N-(2-methylpropyl)cyclopentanamine.

Molecular Properties

Compound Namemethanol;N-(2-methylpropyl)cyclopentanamine
PubChem CID166557930
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Namemethanol;N-(2-methylpropyl)cyclopentanamine
SMILESCC(C)CNC1CCCC1.CO
InChIInChI=1S/C9H19N.CH4O/c1-8(2)7-10-9-5-3-4-6-9;1-2/h8-10H,3-7H2,1-2H3;2H,1H3
InChIKeyKUBYJVBFGSUVFT-UHFFFAOYSA-N
XLogP1.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of methanol;N-(2-methylpropyl)cyclopentanamine?
The IUPAC name of methanol;N-(2-methylpropyl)cyclopentanamine (CID 166557930) is methanol;N-(2-methylpropyl)cyclopentanamine.
What is the SMILES notation for methanol;N-(2-methylpropyl)cyclopentanamine?
The canonical SMILES for methanol;N-(2-methylpropyl)cyclopentanamine is CC(C)CNC1CCCC1.CO.
What is the InChIKey of methanol;N-(2-methylpropyl)cyclopentanamine?
The InChIKey is KUBYJVBFGSUVFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.CH4O/c1-8(2)7-10-9-5-3-4-6-9;1-2/h8-10H,3-7H2,1-2H3;2H,1H3.
What are the key properties of methanol;N-(2-methylpropyl)cyclopentanamine?
methanol;N-(2-methylpropyl)cyclopentanamine has a molecular weight of 173.30 g/mol, XLogP of 1.78, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;N-(2-methylpropyl)cyclopentanamine is sourced from PubChem (CID 166557930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).