2,4-di(propan-2-yl)oxetan-3-amine

C9H19NO — CID 135394203

IUPAC2,4-di(propan-2-yl)oxetan-3-amine
SMILESCC(C)C1OC(C(C)C)C1N
InChIInChI=1S/C9H19NO/c1-5(2)8-7(10)9(11-8)6(3)4/h5-9H,10H2,1-4H3
InChIKeyFYJWPJINTRFCLQ-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.39
Rot. Bonds2

About 2,4-di(propan-2-yl)oxetan-3-amine

2,4-di(propan-2-yl)oxetan-3-amine (PubChem CID 135394203) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 2,4-di(propan-2-yl)oxetan-3-amine.

Molecular Properties

Compound Name2,4-di(propan-2-yl)oxetan-3-amine
PubChem CID135394203
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name2,4-di(propan-2-yl)oxetan-3-amine
SMILESCC(C)C1OC(C(C)C)C1N
InChIInChI=1S/C9H19NO/c1-5(2)8-7(10)9(11-8)6(3)4/h5-9H,10H2,1-4H3
InChIKeyFYJWPJINTRFCLQ-UHFFFAOYSA-N
XLogP1.39
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,3S,4R,5S)-3,4-dimethyl-2,5-di(propan-2-yl)oxolane
CID 130441371
N-methyl-1-(3-propan-2-yloxiran-2-yl)ethanamine
CID 167005290
(2R,3S,4R,5S)-3,4-difluoro-2,5-di(propan-2-yl)oxolane
CID 164775725
(2S,3S,4S,5R)-3,4-difluoro-2,5-di(propan-2-yl)oxolane
CID 164775785
6-propan-2-yl-1,3,5-trioxane-2,4-diamine
CID 163802342
2-ethyl-3-propan-2-yloxirane
CID 22934413
3-amino-2,5-di(propan-2-yl)-6-(propoxymethyl)oxan-4-ol
CID 139493099
2-pentan-3-yl-3-propan-2-yloxirane
CID 22934396
(2R,3S,4S,5S)-4-fluoro-2,5-di(propan-2-yl)oxolan-3-ol
CID 164775784
2,4,5-tri(propan-2-yl)-1,3-oxazolidine
CID 166020016
(2S,3S)-4-amino-6-methyl-2-propan-2-yloxan-3-ol
CID 89225706
(3S,6R)-3-propan-2-yl-2,7-dioxabicyclo[4.1.0]heptane-4,5-diol
CID 89234801

Frequently Asked Questions

What is the IUPAC name of 2,4-di(propan-2-yl)oxetan-3-amine?
The IUPAC name of 2,4-di(propan-2-yl)oxetan-3-amine (CID 135394203) is 2,4-di(propan-2-yl)oxetan-3-amine.
What is the SMILES notation for 2,4-di(propan-2-yl)oxetan-3-amine?
The canonical SMILES for 2,4-di(propan-2-yl)oxetan-3-amine is CC(C)C1OC(C(C)C)C1N.
What is the InChIKey of 2,4-di(propan-2-yl)oxetan-3-amine?
The InChIKey is FYJWPJINTRFCLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-5(2)8-7(10)9(11-8)6(3)4/h5-9H,10H2,1-4H3.
What are the key properties of 2,4-di(propan-2-yl)oxetan-3-amine?
2,4-di(propan-2-yl)oxetan-3-amine has a molecular weight of 157.26 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-di(propan-2-yl)oxetan-3-amine is sourced from PubChem (CID 135394203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).