2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide

C13H25N3O — CID 82763899

IUPAC2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide
SMILESCN1CCC(NC(=O)C2(C)CCCC2N)CC1
InChIInChI=1S/C13H25N3O/c1-13(7-3-4-11(13)14)12(17)15-10-5-8-16(2)9-6-10/h10-11H,3-9,14H2,1-2H3,(H,15,17)
InChIKeyYKRHMFPTZHMYSS-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.71
Rot. Bonds2

About 2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide

2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide (PubChem CID 82763899) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide
PubChem CID82763899
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide
SMILESCN1CCC(NC(=O)C2(C)CCCC2N)CC1
InChIInChI=1S/C13H25N3O/c1-13(7-3-4-11(13)14)12(17)15-10-5-8-16(2)9-6-10/h10-11H,3-9,14H2,1-2H3,(H,15,17)
InChIKeyYKRHMFPTZHMYSS-UHFFFAOYSA-N
XLogP0.71
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 ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-1-methylcyclopentane-1-carboxamide
CID 82765258
2-amino-1-methyl-N-(4-methylcyclohexyl)cyclopentane-1-carboxamide
CID 82765593
2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-1-methylcyclopentane-1-carboxamide
CID 82758016
2-amino-N-(3,5-dimethylcyclohexyl)-1-methylcyclopentane-1-carboxamide
CID 82767720
2-amino-N-(2,2-dimethylcyclohexyl)-1-methylcyclopentane-1-carboxamide
CID 82768367
2-amino-1-methyl-N-(2-pyrrolidin-1-ylethyl)cyclopentane-1-carboxamide
CID 82763901
2-amino-N-(3-ethylpentan-3-yl)-1-methylcyclopentane-1-carboxamide
CID 82767363
N-(2-adamantyl)-2-amino-1-methylcyclopentane-1-carboxamide
CID 82765102
1-(hydroxymethyl)-N-(1-methylpiperidin-4-yl)cyclobutane-1-carboxamide
CID 115183966
(1R)-2-amino-1-methylcyclopentane-1-carboxylic acid
CID 129318014
trans-(1S,2R)-2-amino-1-methylcyclopentane-1-carboxylic acid
CID 55284582
1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid
CID 82767722

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide (CID 82763899) is 2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide is CN1CCC(NC(=O)C2(C)CCCC2N)CC1.
What is the InChIKey of 2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide?
The InChIKey is YKRHMFPTZHMYSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-13(7-3-4-11(13)14)12(17)15-10-5-8-16(2)9-6-10/h10-11H,3-9,14H2,1-2H3,(H,15,17).
What are the key properties of 2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide?
2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 0.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-methyl-N-(1-methylpiperidin-4-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 82763899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).