4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine

C17H34N2O — CID 103035859

IUPAC4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine
SMILESCNC(CCC(C)(C)OC)C1(N2CCCC2)CCCC1
InChIInChI=1S/C17H34N2O/c1-16(2,20-4)12-9-15(18-3)17(10-5-6-11-17)19-13-7-8-14-19/h15,18H,5-14H2,1-4H3
InChIKeyLCBAYXVYVISSSQ-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.19
Rot. Bonds7

About 4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine

4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine (PubChem CID 103035859) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine.

Molecular Properties

Compound Name4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine
PubChem CID103035859
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine
SMILESCNC(CCC(C)(C)OC)C1(N2CCCC2)CCCC1
InChIInChI=1S/C17H34N2O/c1-16(2,20-4)12-9-15(18-3)17(10-5-6-11-17)19-13-7-8-14-19/h15,18H,5-14H2,1-4H3
InChIKeyLCBAYXVYVISSSQ-UHFFFAOYSA-N
XLogP3.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine?
The IUPAC name of 4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine (CID 103035859) is 4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine.
What is the SMILES notation for 4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine?
The canonical SMILES for 4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine is CNC(CCC(C)(C)OC)C1(N2CCCC2)CCCC1.
What is the InChIKey of 4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine?
The InChIKey is LCBAYXVYVISSSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-16(2,20-4)12-9-15(18-3)17(10-5-6-11-17)19-13-7-8-14-19/h15,18H,5-14H2,1-4H3.
What are the key properties of 4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine?
4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine has a molecular weight of 282.47 g/mol, XLogP of 3.19, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,4-dimethyl-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-amine is sourced from PubChem (CID 103035859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).