N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine

C12H24N2 — CID 79644126

IUPACN-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine
SMILESCCNC1CCC(N2CCCC2C)C1
InChIInChI=1S/C12H24N2/c1-3-13-11-6-7-12(9-11)14-8-4-5-10(14)2/h10-13H,3-9H2,1-2H3
InChIKeyXKEIQRURFSYJIV-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.00
Rot. Bonds3

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

N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine (PubChem CID 79644126) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine
PubChem CID79644126
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine
SMILESCCNC1CCC(N2CCCC2C)C1
InChIInChI=1S/C12H24N2/c1-3-13-11-6-7-12(9-11)14-8-4-5-10(14)2/h10-13H,3-9H2,1-2H3
InChIKeyXKEIQRURFSYJIV-UHFFFAOYSA-N
XLogP2.00
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine?
The IUPAC name of N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine (CID 79644126) is N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine.
What is the SMILES notation for N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine?
The canonical SMILES for N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine is CCNC1CCC(N2CCCC2C)C1.
What is the InChIKey of N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine?
The InChIKey is XKEIQRURFSYJIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-3-13-11-6-7-12(9-11)14-8-4-5-10(14)2/h10-13H,3-9H2,1-2H3.
What are the key properties of N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine?
N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine has a molecular weight of 196.34 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine is sourced from PubChem (CID 79644126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).