N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide

C13H19N3O — CID 107148527

IUPACN-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide
SMILESCc1cccnc1CC(=O)NCC(N)C1CC1
InChIInChI=1S/C13H19N3O/c1-9-3-2-6-15-12(9)7-13(17)16-8-11(14)10-4-5-10/h2-3,6,10-11H,4-5,7-8,14H2,1H3,(H,16,17)
InChIKeyBKWLUVGVDLEQMM-UHFFFAOYSA-N
MW233.31 g/mol
LogP0.79
Rot. Bonds5

About N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide

N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide (PubChem CID 107148527) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide
PubChem CID107148527
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide
SMILESCc1cccnc1CC(=O)NCC(N)C1CC1
InChIInChI=1S/C13H19N3O/c1-9-3-2-6-15-12(9)7-13(17)16-8-11(14)10-4-5-10/h2-3,6,10-11H,4-5,7-8,14H2,1H3,(H,16,17)
InChIKeyBKWLUVGVDLEQMM-UHFFFAOYSA-N
XLogP0.79
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Disopyramide
CID 3114
Norcotinine
CID 413
Ximelegatran
CID 448042
Mono-N-dealkyldisopyramide
CID 107858
Vamicamide
CID 65967
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
Bupicomide
CID 31447
Disopyramide, (R)-
CID 156294
Phenatine
CID 120640
Y-27632 dihydrochloride
CID 9901617
2-Pyridineacetamide
CID 227129

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide?
The IUPAC name of N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide (CID 107148527) is N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide?
The canonical SMILES for N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide is Cc1cccnc1CC(=O)NCC(N)C1CC1.
What is the InChIKey of N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide?
The InChIKey is BKWLUVGVDLEQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9-3-2-6-15-12(9)7-13(17)16-8-11(14)10-4-5-10/h2-3,6,10-11H,4-5,7-8,14H2,1H3,(H,16,17).
What are the key properties of N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide?
N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide has a molecular weight of 233.31 g/mol, XLogP of 0.79, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 107148527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).