N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine

C12H25N3 — CID 58529224

IUPACN-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine
SMILESCNCC1CCC(N2CCN(C)CC2)C1
InChIInChI=1S/C12H25N3/c1-13-10-11-3-4-12(9-11)15-7-5-14(2)6-8-15/h11-13H,3-10H2,1-2H3
InChIKeyGDISAXHRFWGXFM-UHFFFAOYSA-N
MW211.35 g/mol
LogP0.62
Rot. Bonds3

About N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine

N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine (PubChem CID 58529224) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine
PubChem CID58529224
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC NameN-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine
SMILESCNCC1CCC(N2CCN(C)CC2)C1
InChIInChI=1S/C12H25N3/c1-13-10-11-3-4-12(9-11)15-7-5-14(2)6-8-15/h11-13H,3-10H2,1-2H3
InChIKeyGDISAXHRFWGXFM-UHFFFAOYSA-N
XLogP0.62
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine?
The IUPAC name of N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine (CID 58529224) is N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine.
What is the SMILES notation for N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine?
The canonical SMILES for N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine is CNCC1CCC(N2CCN(C)CC2)C1.
What is the InChIKey of N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine?
The InChIKey is GDISAXHRFWGXFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-13-10-11-3-4-12(9-11)15-7-5-14(2)6-8-15/h11-13H,3-10H2,1-2H3.
What are the key properties of N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine?
N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine has a molecular weight of 211.35 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[3-(4-methylpiperazin-1-yl)cyclopentyl]methanamine is sourced from PubChem (CID 58529224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).