N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine

C11H23NO2 — CID 115689093

IUPACN-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine
SMILESCC(C)COCC(C)NC1CCOC1
InChIInChI=1S/C11H23NO2/c1-9(2)6-14-7-10(3)12-11-4-5-13-8-11/h9-12H,4-8H2,1-3H3
InChIKeyBLARWSBMAZJOHE-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.43
Rot. Bonds6

About N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine

N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine (PubChem CID 115689093) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine.

Molecular Properties

Compound NameN-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine
PubChem CID115689093
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine
SMILESCC(C)COCC(C)NC1CCOC1
InChIInChI=1S/C11H23NO2/c1-9(2)6-14-7-10(3)12-11-4-5-13-8-11/h9-12H,4-8H2,1-3H3
InChIKeyBLARWSBMAZJOHE-UHFFFAOYSA-N
XLogP1.43
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanamine
CID 115615668
N-(1-bromopropan-2-yl)oxolan-3-amine
CID 107859755
N-[1-(2-methylpropoxy)propan-2-yl]thietan-3-amine
CID 135392551
(3R)-N-[(2S)-1-(2,6-dimethylphenoxy)propan-2-yl]oxolan-3-amine
CID 99849083
N-(2-methylpentan-3-yl)oxolan-3-amine
CID 63335155
(2R)-2-(oxolan-3-ylamino)butan-1-ol
CID 103922432
N-(1-bromo-3-methylbutan-2-yl)oxolan-3-amine
CID 107859241
3-methyl-2-(oxolan-3-ylamino)butan-1-ol
CID 79254853
N-(1-chloro-3-methylbutan-2-yl)oxolan-3-amine
CID 79244715
N-(4-phenylbutan-2-yl)oxolan-3-amine
CID 63331840
2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine
CID 115889323
(3R)-3-(oxan-3-ylamino)butan-1-ol
CID 103871769

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine?
The IUPAC name of N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine (CID 115689093) is N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine.
What is the SMILES notation for N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine?
The canonical SMILES for N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine is CC(C)COCC(C)NC1CCOC1.
What is the InChIKey of N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine?
The InChIKey is BLARWSBMAZJOHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-9(2)6-14-7-10(3)12-11-4-5-13-8-11/h9-12H,4-8H2,1-3H3.
What are the key properties of N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine?
N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine has a molecular weight of 201.31 g/mol, XLogP of 1.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine is sourced from PubChem (CID 115689093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).