2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine

C14H29NO — CID 115894259

IUPAC2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine
SMILESCCC1(CC)C(NC(C)C(C)C)CC1OC
InChIInChI=1S/C14H29NO/c1-7-14(8-2)12(9-13(14)16-6)15-11(5)10(3)4/h10-13,15H,7-9H2,1-6H3
InChIKeyFEXFCPDYGKTJJC-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.21
Rot. Bonds6

About 2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine

2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine (PubChem CID 115894259) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine
PubChem CID115894259
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine
SMILESCCC1(CC)C(NC(C)C(C)C)CC1OC
InChIInChI=1S/C14H29NO/c1-7-14(8-2)12(9-13(14)16-6)15-11(5)10(3)4/h10-13,15H,7-9H2,1-6H3
InChIKeyFEXFCPDYGKTJJC-UHFFFAOYSA-N
XLogP3.21
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine?
The IUPAC name of 2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine (CID 115894259) is 2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine.
What is the SMILES notation for 2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine?
The canonical SMILES for 2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine is CCC1(CC)C(NC(C)C(C)C)CC1OC.
What is the InChIKey of 2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine?
The InChIKey is FEXFCPDYGKTJJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-7-14(8-2)12(9-13(14)16-6)15-11(5)10(3)4/h10-13,15H,7-9H2,1-6H3.
What are the key properties of 2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine?
2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine has a molecular weight of 227.39 g/mol, XLogP of 3.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine is sourced from PubChem (CID 115894259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).