N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine

C15H30N2O — CID 55056481

IUPACN-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine
SMILESCCNCC1(CN(C)CC2CCCO2)CCCC1
InChIInChI=1S/C15H30N2O/c1-3-16-12-15(8-4-5-9-15)13-17(2)11-14-7-6-10-18-14/h14,16H,3-13H2,1-2H3
InChIKeyCQMUZFVPFGDRMX-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds7

About N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine

N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine (PubChem CID 55056481) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine
PubChem CID55056481
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine
SMILESCCNCC1(CN(C)CC2CCCO2)CCCC1
InChIInChI=1S/C15H30N2O/c1-3-16-12-15(8-4-5-9-15)13-17(2)11-14-7-6-10-18-14/h14,16H,3-13H2,1-2H3
InChIKeyCQMUZFVPFGDRMX-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine?
The IUPAC name of N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine (CID 55056481) is N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine.
What is the SMILES notation for N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine?
The canonical SMILES for N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine is CCNCC1(CN(C)CC2CCCO2)CCCC1.
What is the InChIKey of N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine?
The InChIKey is CQMUZFVPFGDRMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-16-12-15(8-4-5-9-15)13-17(2)11-14-7-6-10-18-14/h14,16H,3-13H2,1-2H3.
What are the key properties of N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine?
N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine is sourced from PubChem (CID 55056481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).