N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine

C10H19NO — CID 130621360

IUPACN-[(3-methyloxolan-3-yl)methyl]cyclobutanamine
SMILESCC1(CNC2CCC2)CCOC1
InChIInChI=1S/C10H19NO/c1-10(5-6-12-8-10)7-11-9-3-2-4-9/h9,11H,2-8H2,1H3
InChIKeyHTVXMILEWVNHQM-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.56
Rot. Bonds3

About N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine

N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine (PubChem CID 130621360) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine.

Molecular Properties

Compound NameN-[(3-methyloxolan-3-yl)methyl]cyclobutanamine
PubChem CID130621360
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-[(3-methyloxolan-3-yl)methyl]cyclobutanamine
SMILESCC1(CNC2CCC2)CCOC1
InChIInChI=1S/C10H19NO/c1-10(5-6-12-8-10)7-11-9-3-2-4-9/h9,11H,2-8H2,1H3
InChIKeyHTVXMILEWVNHQM-UHFFFAOYSA-N
XLogP1.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine?
The IUPAC name of N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine (CID 130621360) is N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine.
What is the SMILES notation for N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine?
The canonical SMILES for N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine is CC1(CNC2CCC2)CCOC1.
What is the InChIKey of N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine?
The InChIKey is HTVXMILEWVNHQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-10(5-6-12-8-10)7-11-9-3-2-4-9/h9,11H,2-8H2,1H3.
What are the key properties of N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine?
N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine has a molecular weight of 169.27 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine is sourced from PubChem (CID 130621360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).