1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine

C13H26N2 — CID 65457568

IUPAC1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine
SMILESCCN1CCC(CNCC2CCC2)CC1
InChIInChI=1S/C13H26N2/c1-2-15-8-6-13(7-9-15)11-14-10-12-4-3-5-12/h12-14H,2-11H2,1H3
InChIKeySAXUISNEULUSRJ-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.11
Rot. Bonds5

About 1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine

1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine (PubChem CID 65457568) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine.

Molecular Properties

Compound Name1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine
PubChem CID65457568
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine
SMILESCCN1CCC(CNCC2CCC2)CC1
InChIInChI=1S/C13H26N2/c1-2-15-8-6-13(7-9-15)11-14-10-12-4-3-5-12/h12-14H,2-11H2,1H3
InChIKeySAXUISNEULUSRJ-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclobutylmethyl)-1-ethylpiperidin-4-amine
CID 43298506
N-[(1-ethylpiperidin-4-yl)methyl]prop-2-yn-1-amine
CID 62141446
1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]propan-2-amine
CID 115717000
1-cyclobutyl-N-(cyclobutylmethyl)methanamine
CID 54206114
N-[(1-ethylpiperidin-4-yl)methyl]-3-methylbut-2-en-1-amine
CID 106547114
N-[(1-ethylpiperidin-4-yl)methyl]acetamide
CID 60968762
5-[[(1-ethylpiperidin-4-yl)methylamino]methyl]pyrrolidin-2-one
CID 107529310
1,4-diethylazepane
CID 67522864
1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride
CID 134690905
N-[(1-ethylpiperidin-4-yl)methyl]-4-propylcycloheptan-1-amine
CID 65091371
1-(1-ethylpyrrolidin-3-yl)-N-(oxan-3-ylmethyl)methanamine
CID 63740741
N-[(1-ethylpiperidin-4-yl)methyl]pent-3-yn-1-amine
CID 104806622

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine?
The IUPAC name of 1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine (CID 65457568) is 1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine.
What is the SMILES notation for 1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine?
The canonical SMILES for 1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine is CCN1CCC(CNCC2CCC2)CC1.
What is the InChIKey of 1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine?
The InChIKey is SAXUISNEULUSRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-2-15-8-6-13(7-9-15)11-14-10-12-4-3-5-12/h12-14H,2-11H2,1H3.
What are the key properties of 1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine?
1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine has a molecular weight of 210.36 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-[(1-ethylpiperidin-4-yl)methyl]methanamine is sourced from PubChem (CID 65457568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).