2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine

C11H21NO — CID 130554494

IUPAC2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine
SMILESCC1CCC1NCC1CCOC1C
InChIInChI=1S/C11H21NO/c1-8-3-4-11(8)12-7-10-5-6-13-9(10)2/h8-12H,3-7H2,1-2H3
InChIKeySMOLKVKKRZNULX-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.80
Rot. Bonds3

About 2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine

2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine (PubChem CID 130554494) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine
PubChem CID130554494
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine
SMILESCC1CCC1NCC1CCOC1C
InChIInChI=1S/C11H21NO/c1-8-3-4-11(8)12-7-10-5-6-13-9(10)2/h8-12H,3-7H2,1-2H3
InChIKeySMOLKVKKRZNULX-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine?
The IUPAC name of 2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine (CID 130554494) is 2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine.
What is the SMILES notation for 2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine?
The canonical SMILES for 2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine is CC1CCC1NCC1CCOC1C.
What is the InChIKey of 2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine?
The InChIKey is SMOLKVKKRZNULX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-8-3-4-11(8)12-7-10-5-6-13-9(10)2/h8-12H,3-7H2,1-2H3.
What are the key properties of 2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine?
2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine has a molecular weight of 183.29 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-methyloxolan-3-yl)methyl]cyclobutan-1-amine is sourced from PubChem (CID 130554494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).