2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide

C15H29N3O — CID 119923766

IUPAC2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide
SMILESCNC1CCN(CC(=O)NC2CCCCC2C)CC1
InChIInChI=1S/C15H29N3O/c1-12-5-3-4-6-14(12)17-15(19)11-18-9-7-13(16-2)8-10-18/h12-14,16H,3-11H2,1-2H3,(H,17,19)
InChIKeyLIXNFVPUMZYNCY-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.37
Rot. Bonds4

About 2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide

2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide (PubChem CID 119923766) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide
PubChem CID119923766
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide
SMILESCNC1CCN(CC(=O)NC2CCCCC2C)CC1
InChIInChI=1S/C15H29N3O/c1-12-5-3-4-6-14(12)17-15(19)11-18-9-7-13(16-2)8-10-18/h12-14,16H,3-11H2,1-2H3,(H,17,19)
InChIKeyLIXNFVPUMZYNCY-UHFFFAOYSA-N
XLogP1.37
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide?
The IUPAC name of 2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide (CID 119923766) is 2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide?
The canonical SMILES for 2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide is CNC1CCN(CC(=O)NC2CCCCC2C)CC1.
What is the InChIKey of 2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide?
The InChIKey is LIXNFVPUMZYNCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12-5-3-4-6-14(12)17-15(19)11-18-9-7-13(16-2)8-10-18/h12-14,16H,3-11H2,1-2H3,(H,17,19).
What are the key properties of 2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide?
2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide has a molecular weight of 267.42 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide is sourced from PubChem (CID 119923766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).