(4-aminocyclohexyl)-piperidin-1-ylmethanone

C12H22N2O — CID 60846882

IUPAC(4-aminocyclohexyl)-piperidin-1-ylmethanone
SMILESNC1CCC(C(=O)N2CCCCC2)CC1
InChIInChI=1S/C12H22N2O/c13-11-6-4-10(5-7-11)12(15)14-8-2-1-3-9-14/h10-11H,1-9,13H2
InChIKeyDHXCXYZXKDFBBK-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.52
Rot. Bonds1

About (4-aminocyclohexyl)-piperidin-1-ylmethanone

(4-aminocyclohexyl)-piperidin-1-ylmethanone (PubChem CID 60846882) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is (4-aminocyclohexyl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(4-aminocyclohexyl)-piperidin-1-ylmethanone
PubChem CID60846882
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name(4-aminocyclohexyl)-piperidin-1-ylmethanone
SMILESNC1CCC(C(=O)N2CCCCC2)CC1
InChIInChI=1S/C12H22N2O/c13-11-6-4-10(5-7-11)12(15)14-8-2-1-3-9-14/h10-11H,1-9,13H2
InChIKeyDHXCXYZXKDFBBK-UHFFFAOYSA-N
XLogP1.52
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-aminocyclohexyl)-piperidin-1-ylmethanone?
The IUPAC name of (4-aminocyclohexyl)-piperidin-1-ylmethanone (CID 60846882) is (4-aminocyclohexyl)-piperidin-1-ylmethanone.
What is the SMILES notation for (4-aminocyclohexyl)-piperidin-1-ylmethanone?
The canonical SMILES for (4-aminocyclohexyl)-piperidin-1-ylmethanone is NC1CCC(C(=O)N2CCCCC2)CC1.
What is the InChIKey of (4-aminocyclohexyl)-piperidin-1-ylmethanone?
The InChIKey is DHXCXYZXKDFBBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c13-11-6-4-10(5-7-11)12(15)14-8-2-1-3-9-14/h10-11H,1-9,13H2.
What are the key properties of (4-aminocyclohexyl)-piperidin-1-ylmethanone?
(4-aminocyclohexyl)-piperidin-1-ylmethanone has a molecular weight of 210.32 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminocyclohexyl)-piperidin-1-ylmethanone is sourced from PubChem (CID 60846882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).