2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide

C14H21N3O — CID 107413069

IUPAC2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide
SMILESCC1CCC(CNC(=O)Cc2ccc(N)cn2)C1
InChIInChI=1S/C14H21N3O/c1-10-2-3-11(6-10)8-17-14(18)7-13-5-4-12(15)9-16-13/h4-5,9-11H,2-3,6-8,15H2,1H3,(H,17,18)
InChIKeyCONIQAIHIVMLRP-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.76
Rot. Bonds4

About 2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide

2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide (PubChem CID 107413069) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide
PubChem CID107413069
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide
SMILESCC1CCC(CNC(=O)Cc2ccc(N)cn2)C1
InChIInChI=1S/C14H21N3O/c1-10-2-3-11(6-10)8-17-14(18)7-13-5-4-12(15)9-16-13/h4-5,9-11H,2-3,6-8,15H2,1H3,(H,17,18)
InChIKeyCONIQAIHIVMLRP-UHFFFAOYSA-N
XLogP1.76
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Norcotinine
CID 413
Ximelegatran
CID 448042
alpha-(2-(Bis(1-methylethyl)amino)ethyl)-alpha-(2-methylpropyl)-2-pyridineacetamide
CID 65847
N-(2-(Pyridin-2-yl)ethyl)-3-p-menthanecarboxamide
CID 56969824
2-Pyridineacetamide
CID 227129
2-phenyl-N-pyridin-3-ylbutanamide
CID 4047159
1-phenyl-N-3-pyridinylcyclopentanecarboxamide
CID 744343
3-phenyl-N-pyridin-3-ylpropanamide
CID 683950
1,3-Dihydro-2H-pyrrolo[3,2-b]pyridin-2-one
CID 316367
Demethylcotinine
CID 92223
2-(3-methylphenyl)-N-pyridin-3-ylacetamide
CID 6467227
N-(pyridin-2-ylmethyl)acetamide
CID 5084090

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide (CID 107413069) is 2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide is CC1CCC(CNC(=O)Cc2ccc(N)cn2)C1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide?
The InChIKey is CONIQAIHIVMLRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-10-2-3-11(6-10)8-17-14(18)7-13-5-4-12(15)9-16-13/h4-5,9-11H,2-3,6-8,15H2,1H3,(H,17,18).
What are the key properties of 2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide?
2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide has a molecular weight of 247.34 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide is sourced from PubChem (CID 107413069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).