N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine

C14H28N2O — CID 171439743

IUPACN-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine
SMILESCC(C)OC1CC(N(CC2CNC2)C(C)C)C1
InChIInChI=1S/C14H28N2O/c1-10(2)16(9-12-7-15-8-12)13-5-14(6-13)17-11(3)4/h10-15H,5-9H2,1-4H3
InChIKeyOXDMLFZNOLGEOC-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.87
Rot. Bonds6

About N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine

N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine (PubChem CID 171439743) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine.

Molecular Properties

Compound NameN-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine
PubChem CID171439743
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine
SMILESCC(C)OC1CC(N(CC2CNC2)C(C)C)C1
InChIInChI=1S/C14H28N2O/c1-10(2)16(9-12-7-15-8-12)13-5-14(6-13)17-11(3)4/h10-15H,5-9H2,1-4H3
InChIKeyOXDMLFZNOLGEOC-UHFFFAOYSA-N
XLogP1.87
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-N-[(1-methylazetidin-3-yl)methyl]-N-propan-2-ylcyclobutan-1-amine
CID 146640321
3-[(3S,5R)-5-propan-2-yloxypiperidin-3-yl]propanoic acid
CID 97184538
3-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine
CID 106624200
1-(2-methylpropyl)-3-propan-2-yloxycyclobutane
CID 153444524
N-ethyl-N-propan-2-ylazetidin-3-amine
CID 21024113
N-(cyclohexylmethyl)-3-methyl-N-propan-2-ylcyclobutan-1-amine
CID 167544317
N-(piperidin-4-ylmethyl)-N-propan-2-ylcyclobutanamine;hydrochloride
CID 119932017
4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106624301
3-[[propan-2-yl(sulfamoyl)amino]methyl]azetidine
CID 163274827
dimethyl 4-[3-[piperidin-4-ylmethyl(propan-2-yl)amino]cyclobutyl]oxybenzene-1,2-dicarboxylate;hydron
CID 146502497
cis-(1S,3R)-1,3-dimethyl-5-propan-2-yloxycyclohexane
CID 130223743
1-bromo-3-propan-2-yloxycyclobutane
CID 66344883

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine?
The IUPAC name of N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine (CID 171439743) is N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine.
What is the SMILES notation for N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine?
The canonical SMILES for N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine is CC(C)OC1CC(N(CC2CNC2)C(C)C)C1.
What is the InChIKey of N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine?
The InChIKey is OXDMLFZNOLGEOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-10(2)16(9-12-7-15-8-12)13-5-14(6-13)17-11(3)4/h10-15H,5-9H2,1-4H3.
What are the key properties of N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine?
N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine has a molecular weight of 240.39 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-ylmethyl)-N-propan-2-yl-3-propan-2-yloxycyclobutan-1-amine is sourced from PubChem (CID 171439743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).