ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine

C15H34N2O — CID 170576224

IUPACethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine
SMILESCC.CC.CCNC1CCC(N2CCOCC2)C1
InChIInChI=1S/C11H22N2O.2C2H6/c1-2-12-10-3-4-11(9-10)13-5-7-14-8-6-13;2*1-2/h10-12H,2-9H2,1H3;2*1-2H3
InChIKeyIQTCIFNDNLRZGA-UHFFFAOYSA-N
MW258.45 g/mol
LogP2.90
Rot. Bonds3

About ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine

ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine (PubChem CID 170576224) has the molecular formula C15H34N2O and a molecular weight of 258.45 g/mol. Its IUPAC name is ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine.

Molecular Properties

Compound Nameethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine
PubChem CID170576224
Molecular FormulaC15H34N2O
Molecular Weight258.45 g/mol
Exact Mass258.27
IUPAC Nameethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine
SMILESCC.CC.CCNC1CCC(N2CCOCC2)C1
InChIInChI=1S/C11H22N2O.2C2H6/c1-2-12-10-3-4-11(9-10)13-5-7-14-8-6-13;2*1-2/h10-12H,2-9H2,1H3;2*1-2H3
InChIKeyIQTCIFNDNLRZGA-UHFFFAOYSA-N
XLogP2.90
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.45
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine?
The IUPAC name of ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine (CID 170576224) is ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine.
What is the SMILES notation for ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine?
The canonical SMILES for ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine is CC.CC.CCNC1CCC(N2CCOCC2)C1.
What is the InChIKey of ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine?
The InChIKey is IQTCIFNDNLRZGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O.2C2H6/c1-2-12-10-3-4-11(9-10)13-5-7-14-8-6-13;2*1-2/h10-12H,2-9H2,1H3;2*1-2H3.
What are the key properties of ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine?
ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine has a molecular weight of 258.45 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-3-morpholin-4-ylcyclopentan-1-amine is sourced from PubChem (CID 170576224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).