N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine

C13H26N2O — CID 105415650

IUPACN,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine
SMILESCC1CCC(CNCC2(N(C)C)CCC2)O1
InChIInChI=1S/C13H26N2O/c1-11-5-6-12(16-11)9-14-10-13(15(2)3)7-4-8-13/h11-12,14H,4-10H2,1-3H3
InChIKeyBBLGDXPNABJEBD-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.63
Rot. Bonds5

About N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine

N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine (PubChem CID 105415650) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine
PubChem CID105415650
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine
SMILESCC1CCC(CNCC2(N(C)C)CCC2)O1
InChIInChI=1S/C13H26N2O/c1-11-5-6-12(16-11)9-14-10-13(15(2)3)7-4-8-13/h11-12,14H,4-10H2,1-3H3
InChIKeyBBLGDXPNABJEBD-UHFFFAOYSA-N
XLogP1.63
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclopentyl]methanol
CID 82836590
N',N'-dimethyl-N-[(5-methyloxolan-2-yl)methyl]ethane-1,2-diamine
CID 82834863
N,N,3-trimethyl-1-[(oxolan-2-ylmethylamino)methyl]cyclohexan-1-amine
CID 61212304
2-N,2-N-dimethyl-1-N-[(5-methyloxolan-2-yl)methyl]propane-1,2-diamine
CID 82835760
N-[(5-methyloxolan-2-yl)methyl]-1-(oxolan-2-yl)methanamine
CID 81330041
N'-methyl-N-[(5-methyloxolan-2-yl)methyl]-N'-propan-2-ylpropane-1,3-diamine
CID 106040718
N,N-dimethyl-1-[[(1-methylpiperidin-4-yl)methylamino]methyl]cyclohexan-1-amine
CID 62654686
N-[(5-methyloxolan-2-yl)methyl]-1-(oxan-2-yl)methanamine
CID 82835456
N,N-dimethyl-1-[(thiolan-3-ylmethylamino)methyl]cyclobutan-1-amine
CID 107132507
2-cyclopropyl-N-[(5-methyloxolan-2-yl)methyl]ethanamine
CID 82836481
N,N-dimethyl-1-[[2-(oxolan-2-yl)ethylamino]methyl]cyclobutan-1-amine
CID 105416779
2-ethoxy-N-[(5-methyloxolan-2-yl)methyl]ethanamine
CID 82833976

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine?
The IUPAC name of N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine (CID 105415650) is N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine is CC1CCC(CNCC2(N(C)C)CCC2)O1.
What is the InChIKey of N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine?
The InChIKey is BBLGDXPNABJEBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-11-5-6-12(16-11)9-14-10-13(15(2)3)7-4-8-13/h11-12,14H,4-10H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine?
N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine has a molecular weight of 226.36 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclobutan-1-amine is sourced from PubChem (CID 105415650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).