N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine

C11H22N2 — CID 164846620

IUPACN-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine
SMILESCNC1CCC(N2CC[C@H](C)C2)C1
InChIInChI=1S/C11H22N2/c1-9-5-6-13(8-9)11-4-3-10(7-11)12-2/h9-12H,3-8H2,1-2H3/t9-,10?,11?/m0/s1
InChIKeyYXAJWSRXXJUSLH-WHXUTIOJSA-N
MW182.31 g/mol
LogP1.47
Rot. Bonds2

About N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine

N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine (PubChem CID 164846620) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine.

Molecular Properties

Compound NameN-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine
PubChem CID164846620
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC NameN-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine
SMILESCNC1CCC(N2CC[C@H](C)C2)C1
InChIInChI=1S/C11H22N2/c1-9-5-6-13(8-9)11-4-3-10(7-11)12-2/h9-12H,3-8H2,1-2H3/t9-,10?,11?/m0/s1
InChIKeyYXAJWSRXXJUSLH-WHXUTIOJSA-N
XLogP1.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine?
The IUPAC name of N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine (CID 164846620) is N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine.
What is the SMILES notation for N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine?
The canonical SMILES for N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine is CNC1CCC(N2CC[C@H](C)C2)C1.
What is the InChIKey of N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine?
The InChIKey is YXAJWSRXXJUSLH-WHXUTIOJSA-N. The full InChI is InChI=1S/C11H22N2/c1-9-5-6-13(8-9)11-4-3-10(7-11)12-2/h9-12H,3-8H2,1-2H3/t9-,10?,11?/m0/s1.
What are the key properties of N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine?
N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine has a molecular weight of 182.31 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine is sourced from PubChem (CID 164846620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).