3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine

C13H27NO — CID 65047589

IUPAC3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine
SMILESCCC1CCC(NC(COC)C(C)C)C1
InChIInChI=1S/C13H27NO/c1-5-11-6-7-12(8-11)14-13(9-15-4)10(2)3/h10-14H,5-9H2,1-4H3
InChIKeyOCDUQYSULVKVTD-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.83
Rot. Bonds6

About 3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine

3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine (PubChem CID 65047589) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine
PubChem CID65047589
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine
SMILESCCC1CCC(NC(COC)C(C)C)C1
InChIInChI=1S/C13H27NO/c1-5-11-6-7-12(8-11)14-13(9-15-4)10(2)3/h10-14H,5-9H2,1-4H3
InChIKeyOCDUQYSULVKVTD-UHFFFAOYSA-N
XLogP2.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
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

4-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cycloheptan-1-amine
CID 65088356
2-[(3-ethylcyclopentyl)amino]-3-methylpentan-1-ol
CID 115891675
N-(1-ethoxy-3-methylbutan-2-yl)-3-methylcyclopentan-1-amine
CID 103271735
N-(1-methoxy-3-methylbutan-2-yl)-1-methylpiperidin-4-amine
CID 65047718
N-[(1R)-1-cyclopentylethyl]-3-ethylcyclopentan-1-amine
CID 81395536
4-tert-butyl-N-(1-methoxy-3-methylbutan-2-yl)cycloheptan-1-amine
CID 65089987
N-(1-methoxy-3-methylbutan-2-yl)-3,3,5,5-tetramethylcyclohexan-1-amine
CID 112682160
3-[(3-ethylcyclohexyl)amino]-4-methylpentan-1-ol
CID 115656026
(3R)-3-ethyl-N-methylcyclopentan-1-amine
CID 143473182
N-(1-methoxy-3-methylbutan-2-yl)-1-methylazepan-4-amine
CID 65075295
1-cyclopropyl-N-(1-methoxy-3-methylbutan-2-yl)pyrrolidin-3-amine
CID 65047874
3-ethyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]cyclopentan-1-amine
CID 81397757

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine?
The IUPAC name of 3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine (CID 65047589) is 3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine.
What is the SMILES notation for 3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine?
The canonical SMILES for 3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine is CCC1CCC(NC(COC)C(C)C)C1.
What is the InChIKey of 3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine?
The InChIKey is OCDUQYSULVKVTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-5-11-6-7-12(8-11)14-13(9-15-4)10(2)3/h10-14H,5-9H2,1-4H3.
What are the key properties of 3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine?
3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine has a molecular weight of 213.36 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(1-methoxy-3-methylbutan-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 65047589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).