ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide

C12H20N2O — CID 166478148

IUPACethane;N-(4-propan-2-yl-2-pyridinyl)acetamide
SMILESCC.CC(=O)Nc1cc(C(C)C)ccn1
InChIInChI=1S/C10H14N2O.C2H6/c1-7(2)9-4-5-11-10(6-9)12-8(3)13;1-2/h4-7H,1-3H3,(H,11,12,13);1-2H3
InChIKeyJPBPHBWRYMFZIR-UHFFFAOYSA-N
MW208.30 g/mol
LogP3.19
Rot. Bonds2

About ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide

ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide (PubChem CID 166478148) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide.

Molecular Properties

Compound Nameethane;N-(4-propan-2-yl-2-pyridinyl)acetamide
PubChem CID166478148
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Nameethane;N-(4-propan-2-yl-2-pyridinyl)acetamide
SMILESCC.CC(=O)Nc1cc(C(C)C)ccn1
InChIInChI=1S/C10H14N2O.C2H6/c1-7(2)9-4-5-11-10(6-9)12-8(3)13;1-2/h4-7H,1-3H3,(H,11,12,13);1-2H3
InChIKeyJPBPHBWRYMFZIR-UHFFFAOYSA-N
XLogP3.19
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl N-(4-propan-2-yl-2-pyridinyl)carbamate
CID 168928521
N-(6-acetamido-4-propan-2-yl-2-pyridinyl)acetamide
CID 146385375
1-[4-[(4-propan-2-yl-2-pyridinyl)amino]piperidin-1-yl]ethanone
CID 118929980
4-propan-2-yl-N-pyridin-2-ylpyridin-2-amine
CID 130369699
N-(4-bromo-2-pyridinyl)-4-propan-2-ylbenzamide
CID 102674107
N-cyclopentyl-4-propan-2-ylpyridin-2-amine
CID 130369726
2-[(2-acetamido-4-pyridinyl)methylsulfanyl]-N-(3-propan-2-ylphenyl)benzamide
CID 23151002
tert-butyl N-[4-(1-aminoethyl)-2-pyridinyl]carbamate
CID 172639114
N-[4-(difluoromethyl)-2-pyridinyl]benzamide
CID 118627561
N-[4-(methoxymethyl)-2-pyridinyl]acetamide
CID 59578573
N-[4-(2-methylbutan-2-yl)-2-pyridinyl]acetamide
CID 138525024
N-(2-bromo-5-propan-2-ylphenyl)acetamide
CID 117060423

Frequently Asked Questions

What is the IUPAC name of ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide?
The IUPAC name of ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide (CID 166478148) is ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide.
What is the SMILES notation for ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide?
The canonical SMILES for ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide is CC.CC(=O)Nc1cc(C(C)C)ccn1.
What is the InChIKey of ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide?
The InChIKey is JPBPHBWRYMFZIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O.C2H6/c1-7(2)9-4-5-11-10(6-9)12-8(3)13;1-2/h4-7H,1-3H3,(H,11,12,13);1-2H3.
What are the key properties of ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide?
ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide has a molecular weight of 208.30 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(4-propan-2-yl-2-pyridinyl)acetamide is sourced from PubChem (CID 166478148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).