2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine

C9H19NO — CID 66358393

IUPAC2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine
SMILESCC(C)OC1CC(N)C1(C)C
InChIInChI=1S/C9H19NO/c1-6(2)11-8-5-7(10)9(8,3)4/h6-8H,5,10H2,1-4H3
InChIKeyRDFVLCNOBZQYRK-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.54
Rot. Bonds2

About 2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine

2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine (PubChem CID 66358393) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine
PubChem CID66358393
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine
SMILESCC(C)OC1CC(N)C1(C)C
InChIInChI=1S/C9H19NO/c1-6(2)11-8-5-7(10)9(8,3)4/h6-8H,5,10H2,1-4H3
InChIKeyRDFVLCNOBZQYRK-UHFFFAOYSA-N
XLogP1.54
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 ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclobutanol, 3-amino-2,2,4,4-tetramethyl-
CID 203376
3-Ethoxy-2,2-dimethylcyclobutan-1-amine
CID 53619938
3-Butoxy-2,2-dimethylcyclobutan-1-amine
CID 66356849
2,2-Dimethyl-3-(2-methylpropoxy)cyclobutan-1-amine
CID 53619936
3-Ethoxy-2,2-diethylcyclobutan-1-amine
CID 64568592
3-(Tert-butoxy)-2,2-dimethylcyclobutan-1-amine
CID 66357626
3-Methoxy-2,2-dimethylcyclobutan-1-amine
CID 66357768
2,2-Diethyl-3-methoxycyclobutan-1-amine
CID 66358177
2,2-Diethyl-3-methoxy-4-methylcyclobutan-1-amine
CID 71757966
3-Methoxy-2,2,4-trimethylcyclobutan-1-amine hydrochloride
CID 71758158
rac-(1R,3S)-3-(tert-butoxy)-2,2-dimethylcyclobutan-1-amine hydrochloride
CID 121553446
3-Methoxy-2,2,4,4-tetramethylcyclobutan-1-amine hydrochloride
CID 139013310

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine?
The IUPAC name of 2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine (CID 66358393) is 2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine.
What is the SMILES notation for 2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine?
The canonical SMILES for 2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine is CC(C)OC1CC(N)C1(C)C.
What is the InChIKey of 2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine?
The InChIKey is RDFVLCNOBZQYRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-6(2)11-8-5-7(10)9(8,3)4/h6-8H,5,10H2,1-4H3.
What are the key properties of 2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine?
2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine has a molecular weight of 157.26 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-propan-2-yloxycyclobutan-1-amine is sourced from PubChem (CID 66358393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).