2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine

C16H33NO — CID 66359399

IUPAC2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine
SMILESCCCNC1CC(OCCC(C)C)C1(CC)CC
InChIInChI=1S/C16H33NO/c1-6-10-17-14-12-15(16(14,7-2)8-3)18-11-9-13(4)5/h13-15,17H,6-12H2,1-5H3
InChIKeyYUVXVXUMQVSVEE-UHFFFAOYSA-N
MW255.45 g/mol
LogP4.00
Rot. Bonds9

About 2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine

2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine (PubChem CID 66359399) has the molecular formula C16H33NO and a molecular weight of 255.45 g/mol. Its IUPAC name is 2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine.

Molecular Properties

Compound Name2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine
PubChem CID66359399
Molecular FormulaC16H33NO
Molecular Weight255.45 g/mol
Exact Mass255.26
IUPAC Name2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine
SMILESCCCNC1CC(OCCC(C)C)C1(CC)CC
InChIInChI=1S/C16H33NO/c1-6-10-17-14-12-15(16(14,7-2)8-3)18-11-9-13(4)5/h13-15,17H,6-12H2,1-5H3
InChIKeyYUVXVXUMQVSVEE-UHFFFAOYSA-N
XLogP4.00
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-butoxy-2,2-diethyl-N-propylcyclobutan-1-amine
CID 66356852
2,2-diethyl-3-(2-methoxyethoxy)-N-propylcyclobutan-1-amine
CID 66357579
3-(2-ethoxyethoxy)-2,2-diethyl-N-propylcyclobutan-1-amine
CID 66359597
2,2-diethyl-3-(3-methoxypropoxy)-N-propylcyclobutan-1-amine
CID 66353076
2,2-diethyl-3-(1-methoxypropan-2-yloxy)-N-propylcyclobutan-1-amine
CID 66350058
N,2,2-triethyl-3-propoxycyclobutan-1-amine
CID 66358672
N,2,2-triethyl-3-propan-2-yloxycyclobutan-1-amine
CID 66359205
2,2-diethyl-N-methyl-3-propoxycyclobutan-1-amine
CID 66358674
3-[(4-bromophenyl)methoxy]-2,2-diethyl-N-propylcyclobutan-1-amine
CID 82808639
2,2-diethyl-3-(oxolan-3-ylmethoxy)-N-propylcyclobutan-1-amine
CID 66350677
3-ethoxy-2,2-diethyl-N-(3-fluoropropyl)cyclobutan-1-amine
CID 115906505
3-butoxy-2-ethyl-2-methyl-N-propylcyclobutan-1-amine
CID 66356652

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine?
The IUPAC name of 2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine (CID 66359399) is 2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine.
What is the SMILES notation for 2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine?
The canonical SMILES for 2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine is CCCNC1CC(OCCC(C)C)C1(CC)CC.
What is the InChIKey of 2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine?
The InChIKey is YUVXVXUMQVSVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO/c1-6-10-17-14-12-15(16(14,7-2)8-3)18-11-9-13(4)5/h13-15,17H,6-12H2,1-5H3.
What are the key properties of 2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine?
2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine has a molecular weight of 255.45 g/mol, XLogP of 4.00, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine is sourced from PubChem (CID 66359399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).