1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine

C15H31NO — CID 116759893

IUPAC1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine
SMILESCCOC(CC)(CC)C(CC1CCCC1)NC
InChIInChI=1S/C15H31NO/c1-5-15(6-2,17-7-3)14(16-4)12-13-10-8-9-11-13/h13-14,16H,5-12H2,1-4H3
InChIKeyBLBAMBSSKZUSRF-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.75
Rot. Bonds8

About 1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine

1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine (PubChem CID 116759893) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine
PubChem CID116759893
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine
SMILESCCOC(CC)(CC)C(CC1CCCC1)NC
InChIInChI=1S/C15H31NO/c1-5-15(6-2,17-7-3)14(16-4)12-13-10-8-9-11-13/h13-14,16H,5-12H2,1-4H3
InChIKeyBLBAMBSSKZUSRF-UHFFFAOYSA-N
XLogP3.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1-cyclobutyl-3-ethoxy-3-methylpentan-2-yl)hydrazine
CID 105274806
3-ethoxy-3-ethyl-N-methylheptan-4-amine
CID 116759889
3-ethoxy-3-ethyl-N-methyl-1-propan-2-yloxypentan-2-amine
CID 116759938
1-cyclobutyl-3-ethyl-N-methyl-3-pyrrolidin-1-ylpentan-2-amine
CID 79067520
3-ethyl-3-methoxy-N-methyl-1-(1-methylsulfonylpiperidin-3-yl)pentan-2-amine
CID 116760948
1-cyclopentyl-N,3-dimethyl-3-piperidin-1-ylbutan-2-amine
CID 79045410
3-ethoxy-3-ethyl-N-methyloct-6-yn-4-amine
CID 116760027
5-ethoxy-5-ethyl-N,2-dimethylhept-1-en-4-amine
CID 116759842
[2-ethoxy-2-ethyl-1-(3-ethylcyclohexyl)butyl]hydrazine
CID 105275090
1,2-dicyclopentyl-N-methylethanamine
CID 62601762
1-cyclopentyl-N-ethyl-3-methoxy-3-methylbutan-2-amine
CID 79197910
3-ethoxy-3-ethyl-N-methylnon-8-yn-4-amine
CID 116759920

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine?
The IUPAC name of 1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine (CID 116759893) is 1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine.
What is the SMILES notation for 1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine?
The canonical SMILES for 1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine is CCOC(CC)(CC)C(CC1CCCC1)NC.
What is the InChIKey of 1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine?
The InChIKey is BLBAMBSSKZUSRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-5-15(6-2,17-7-3)14(16-4)12-13-10-8-9-11-13/h13-14,16H,5-12H2,1-4H3.
What are the key properties of 1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine?
1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine has a molecular weight of 241.42 g/mol, XLogP of 3.75, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-ethoxy-3-ethyl-N-methylpentan-2-amine is sourced from PubChem (CID 116759893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).