1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine

C13H27NO — CID 103169218

IUPAC1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine
SMILESCCOC1CC(CC(NC)C(C)CC)C1
InChIInChI=1S/C13H27NO/c1-5-10(3)13(14-4)9-11-7-12(8-11)15-6-2/h10-14H,5-9H2,1-4H3
InChIKeyBCDYGXLCFMGBIE-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.83
Rot. Bonds7

About 1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine

1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine (PubChem CID 103169218) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine.

Molecular Properties

Compound Name1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine
PubChem CID103169218
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine
SMILESCCOC1CC(CC(NC)C(C)CC)C1
InChIInChI=1S/C13H27NO/c1-5-10(3)13(14-4)9-11-7-12(8-11)15-6-2/h10-14H,5-9H2,1-4H3
InChIKeyBCDYGXLCFMGBIE-UHFFFAOYSA-N
XLogP2.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-dimethyl-8-(2,2,2-trifluoroethoxy)octan-4-amine
CID 80436658
1-(3-ethoxycyclobutyl)-5,5,5-trifluoro-N-propylpentan-2-amine
CID 103168853
1-(3-ethoxycyclobutyl)-5,5,5-trifluoro-N-methylpentan-2-amine
CID 103168854
1-(3-Ethoxycyclobutyl)-5,5,5-trifluoropentan-2-amine
CID 103168855
1-(3-ethoxycyclobutyl)-N-ethyl-5,5,5-trifluoropentan-2-amine
CID 103168856
1-(3-ethoxycyclobutyl)-6,6,6-trifluoro-N-propylhexan-2-amine
CID 103169304
1-(3-Ethoxycyclobutyl)-6,6,6-trifluorohexan-2-amine
CID 103169305
1-(3-ethoxycyclobutyl)-N-ethyl-6,6,6-trifluorohexan-2-amine
CID 103169308
1-(3-ethoxycyclobutyl)-6,6,6-trifluoro-N-methylhexan-2-amine
CID 113783723
N-methyl-1-(2-methyl-6-propan-2-yloxan-3-yl)methanamine
CID 59435713
N,3-dimethyl-1-(oxolan-2-yl)butan-1-amine
CID 65328294
2-(4-Methoxybutyl)-3-methylpiperidine
CID 89265084

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine?
The IUPAC name of 1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine (CID 103169218) is 1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine.
What is the SMILES notation for 1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine?
The canonical SMILES for 1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine is CCOC1CC(CC(NC)C(C)CC)C1.
What is the InChIKey of 1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine?
The InChIKey is BCDYGXLCFMGBIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-5-10(3)13(14-4)9-11-7-12(8-11)15-6-2/h10-14H,5-9H2,1-4H3.
What are the key properties of 1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine?
1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine has a molecular weight of 213.36 g/mol, XLogP of 2.83, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxycyclobutyl)-N,3-dimethylpentan-2-amine is sourced from PubChem (CID 103169218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).