N-[4-(2-methylpropyl)-3-pyridinyl]acetamide

C11H16N2O — CID 123762017

IUPACN-[4-(2-methylpropyl)-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cnccc1CC(C)C
InChIInChI=1S/C11H16N2O/c1-8(2)6-10-4-5-12-7-11(10)13-9(3)14/h4-5,7-8H,6H2,1-3H3,(H,13,14)
InChIKeyLMYHSBCXOZIOQE-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.24
Rot. Bonds3

About N-[4-(2-methylpropyl)-3-pyridinyl]acetamide

N-[4-(2-methylpropyl)-3-pyridinyl]acetamide (PubChem CID 123762017) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is N-[4-(2-methylpropyl)-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-(2-methylpropyl)-3-pyridinyl]acetamide
PubChem CID123762017
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC NameN-[4-(2-methylpropyl)-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cnccc1CC(C)C
InChIInChI=1S/C11H16N2O/c1-8(2)6-10-4-5-12-7-11(10)13-9(3)14/h4-5,7-8H,6H2,1-3H3,(H,13,14)
InChIKeyLMYHSBCXOZIOQE-UHFFFAOYSA-N
XLogP2.24
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

sodium 2-(3-acetamido-4-pyridinyl)acetate
CID 166428394
N-(4-amino-3-pyridinyl)acetamide
CID 11593462
N-(3-sulfanyl-4-pyridinyl)acetamide
CID 119086581
1-[4-(2-methylpropyl)-3-pyridinyl]ethanamine
CID 82409851
4-(2-methylpropyl)-3-nitropyridine
CID 165439022
dimethyl 2-[(3-acetamido-4-pyridinyl)methylidene]propanedioate
CID 57449667
N-[4-(hydroxymethyl)-3-pyridinyl]prop-2-enamide
CID 162345670
N-(4-methoxy-3-pyridinyl)-3-methylbutanamide
CID 176872995
(2S)-2-amino-4-methyl-N-(4-methyl-3-pyridinyl)pentanamide
CID 63327835
(2R)-2-methoxy-N-[8-[[(2R)-2-methoxypropanoyl]amino]isoquinolin-5-yl]propanamide
CID 125138786
2-methyl-3-(3-methyl-4-pyridinyl)propanoic acid
CID 115008773
ethyl 3-[(3-acetamidopyridine-4-carbonyl)amino]pyridine-4-carboxylate
CID 71119003

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methylpropyl)-3-pyridinyl]acetamide?
The IUPAC name of N-[4-(2-methylpropyl)-3-pyridinyl]acetamide (CID 123762017) is N-[4-(2-methylpropyl)-3-pyridinyl]acetamide.
What is the SMILES notation for N-[4-(2-methylpropyl)-3-pyridinyl]acetamide?
The canonical SMILES for N-[4-(2-methylpropyl)-3-pyridinyl]acetamide is CC(=O)Nc1cnccc1CC(C)C.
What is the InChIKey of N-[4-(2-methylpropyl)-3-pyridinyl]acetamide?
The InChIKey is LMYHSBCXOZIOQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8(2)6-10-4-5-12-7-11(10)13-9(3)14/h4-5,7-8H,6H2,1-3H3,(H,13,14).
What are the key properties of N-[4-(2-methylpropyl)-3-pyridinyl]acetamide?
N-[4-(2-methylpropyl)-3-pyridinyl]acetamide has a molecular weight of 192.26 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methylpropyl)-3-pyridinyl]acetamide is sourced from PubChem (CID 123762017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).