(1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone

C13H24N2O — CID 24707473

IUPAC(1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)C2(N)CCCCC2)CC1
InChIInChI=1S/C13H24N2O/c1-11-5-9-15(10-6-11)12(16)13(14)7-3-2-4-8-13/h11H,2-10,14H2,1H3
InChIKeyYOBAPZAFTJKTTH-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.91
Rot. Bonds1

About (1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone

(1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone (PubChem CID 24707473) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is (1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone
PubChem CID24707473
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name(1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)C2(N)CCCCC2)CC1
InChIInChI=1S/C13H24N2O/c1-11-5-9-15(10-6-11)12(16)13(14)7-3-2-4-8-13/h11H,2-10,14H2,1H3
InChIKeyYOBAPZAFTJKTTH-UHFFFAOYSA-N
XLogP1.91
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of (1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone (CID 24707473) is (1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for (1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone is CC1CCN(C(=O)C2(N)CCCCC2)CC1.
What is the InChIKey of (1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone?
The InChIKey is YOBAPZAFTJKTTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-11-5-9-15(10-6-11)12(16)13(14)7-3-2-4-8-13/h11H,2-10,14H2,1H3.
What are the key properties of (1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone?
(1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone has a molecular weight of 224.35 g/mol, XLogP of 1.91, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclohexyl)-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 24707473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).