N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide

C19H28N4O2 — CID 175637834

IUPACN-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide
SMILESCc1cc(NC(=O)C(=O)N2CCCC[C@@]2(C)C2CCCC2)cnc1N
InChIInChI=1S/C19H28N4O2/c1-13-11-15(12-21-16(13)20)22-17(24)18(25)23-10-6-5-9-19(23,2)14-7-3-4-8-14/h11-12,14H,3-10H2,1-2H3,(H2,20,21)(H,22,24)/t19-/m0/s1
InChIKeyOQQIGDQOCDMYFL-IBGZPJMESA-N
MW344.46 g/mol
LogP2.87
Rot. Bonds2

About N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide

N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide (PubChem CID 175637834) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide.

Molecular Properties

Compound NameN-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide
PubChem CID175637834
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC NameN-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide
SMILESCc1cc(NC(=O)C(=O)N2CCCC[C@@]2(C)C2CCCC2)cnc1N
InChIInChI=1S/C19H28N4O2/c1-13-11-15(12-21-16(13)20)22-17(24)18(25)23-10-6-5-9-19(23,2)14-7-3-4-8-14/h11-12,14H,3-10H2,1-2H3,(H2,20,21)(H,22,24)/t19-/m0/s1
InChIKeyOQQIGDQOCDMYFL-IBGZPJMESA-N
XLogP2.87
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide?
The IUPAC name of N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide (CID 175637834) is N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide.
What is the SMILES notation for N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide?
The canonical SMILES for N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide is Cc1cc(NC(=O)C(=O)N2CCCC[C@@]2(C)C2CCCC2)cnc1N.
What is the InChIKey of N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide?
The InChIKey is OQQIGDQOCDMYFL-IBGZPJMESA-N. The full InChI is InChI=1S/C19H28N4O2/c1-13-11-15(12-21-16(13)20)22-17(24)18(25)23-10-6-5-9-19(23,2)14-7-3-4-8-14/h11-12,14H,3-10H2,1-2H3,(H2,20,21)(H,22,24)/t19-/m0/s1.
What are the key properties of N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide?
N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide has a molecular weight of 344.46 g/mol, XLogP of 2.87, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S)-2-cyclopentyl-2-methylpiperidin-1-yl]-2-oxoacetamide is sourced from PubChem (CID 175637834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).