1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide

C13H25N3O — CID 83021218

IUPAC1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide
SMILESCC1CCCC(C)N1NC(=O)C1(N)CCCC1
InChIInChI=1S/C13H25N3O/c1-10-6-5-7-11(2)16(10)15-12(17)13(14)8-3-4-9-13/h10-11H,3-9,14H2,1-2H3,(H,15,17)
InChIKeyZKGAWNJZINHTIK-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.55
Rot. Bonds2

About 1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide

1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide (PubChem CID 83021218) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide
PubChem CID83021218
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide
SMILESCC1CCCC(C)N1NC(=O)C1(N)CCCC1
InChIInChI=1S/C13H25N3O/c1-10-6-5-7-11(2)16(10)15-12(17)13(14)8-3-4-9-13/h10-11H,3-9,14H2,1-2H3,(H,15,17)
InChIKeyZKGAWNJZINHTIK-UHFFFAOYSA-N
XLogP1.55
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide (CID 83021218) is 1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide is CC1CCCC(C)N1NC(=O)C1(N)CCCC1.
What is the InChIKey of 1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide?
The InChIKey is ZKGAWNJZINHTIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-10-6-5-7-11(2)16(10)15-12(17)13(14)8-3-4-9-13/h10-11H,3-9,14H2,1-2H3,(H,15,17).
What are the key properties of 1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide?
1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2,6-dimethylpiperidin-1-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 83021218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).