N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine

C11H21NO — CID 131199766

IUPACN,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine
SMILESCC1CC(N(C)CC2CCCO2)C1
InChIInChI=1S/C11H21NO/c1-9-6-10(7-9)12(2)8-11-4-3-5-13-11/h9-11H,3-8H2,1-2H3
InChIKeyPUGRRYFGJYNTBN-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.90
Rot. Bonds3

About N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine

N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine (PubChem CID 131199766) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine.

Molecular Properties

Compound NameN,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine
PubChem CID131199766
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine
SMILESCC1CC(N(C)CC2CCCO2)C1
InChIInChI=1S/C11H21NO/c1-9-6-10(7-9)12(2)8-11-4-3-5-13-11/h9-11H,3-8H2,1-2H3
InChIKeyPUGRRYFGJYNTBN-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-N-(oxolan-2-ylmethyl)butan-1-amine
CID 10998362
N-methyl-2-(2-methylpropoxy)-N-[[(2S)-oxolan-2-yl]methyl]ethanamine
CID 100735189
N-fluoro-3-methyl-N-(oxolan-2-ylmethyl)butan-1-amine
CID 88699472
4-Fluoro-1,4-dimethyl-2-(propan-2-yloxymethyl)pyrrolidine
CID 163575207
2-(Ethoxymethyl)-1-(3-ethyl-3-fluorocyclobutyl)pyrrolidine
CID 168880823
2-(Ethoxymethyl)-1-(3-fluoro-3-methylcyclobutyl)pyrrolidine
CID 168880932
1-(3-Fluoro-3-methylcyclobutyl)-2-(methoxymethyl)pyrrolidine
CID 169852935
(2S,4S)-4-(fluoromethyl)-1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine
CID 172177731
(2S)-4-fluoro-1,4-dimethyl-2-(propan-2-yloxymethyl)pyrrolidine
CID 175612113
(2S)-4-fluoro-1,4-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]pyrrolidine
CID 175612152
(2S,4S)-4-fluoro-1-methyl-2-[(1S)-1-[(2R)-3-methylbutan-2-yl]oxyethyl]pyrrolidine
CID 175614273
4-(Fluoromethyl)-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine
CID 176568453

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine?
The IUPAC name of N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine (CID 131199766) is N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine.
What is the SMILES notation for N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine?
The canonical SMILES for N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine is CC1CC(N(C)CC2CCCO2)C1.
What is the InChIKey of N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine?
The InChIKey is PUGRRYFGJYNTBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9-6-10(7-9)12(2)8-11-4-3-5-13-11/h9-11H,3-8H2,1-2H3.
What are the key properties of N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine?
N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine has a molecular weight of 183.29 g/mol, XLogP of 1.90, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine is sourced from PubChem (CID 131199766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).