1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine

C15H31N3 — CID 64681854

IUPAC1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine
SMILESCN1CCC(CN(C)CCC2(N)CCCC2)CC1
InChIInChI=1S/C15H31N3/c1-17-10-5-14(6-11-17)13-18(2)12-9-15(16)7-3-4-8-15/h14H,3-13,16H2,1-2H3
InChIKeyIVWHEOWZFCTGAR-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.92
Rot. Bonds5

About 1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine

1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine (PubChem CID 64681854) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine
PubChem CID64681854
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine
SMILESCN1CCC(CN(C)CCC2(N)CCCC2)CC1
InChIInChI=1S/C15H31N3/c1-17-10-5-14(6-11-17)13-18(2)12-9-15(16)7-3-4-8-15/h14H,3-13,16H2,1-2H3
InChIKeyIVWHEOWZFCTGAR-UHFFFAOYSA-N
XLogP1.92
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine?
The IUPAC name of 1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine (CID 64681854) is 1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine.
What is the SMILES notation for 1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine?
The canonical SMILES for 1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine is CN1CCC(CN(C)CCC2(N)CCCC2)CC1.
What is the InChIKey of 1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine?
The InChIKey is IVWHEOWZFCTGAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-17-10-5-14(6-11-17)13-18(2)12-9-15(16)7-3-4-8-15/h14H,3-13,16H2,1-2H3.
What are the key properties of 1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine?
1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine has a molecular weight of 253.43 g/mol, XLogP of 1.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine is sourced from PubChem (CID 64681854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).