ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine

C14H27N3O — CID 176566621

IUPACethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine
SMILESCC.CC.[H]/N=C(\C)c1c(NC)cc(C)nc1OC
InChIInChI=1S/C10H15N3O.2C2H6/c1-6-5-8(12-3)9(7(2)11)10(13-6)14-4;2*1-2/h5,11H,1-4H3,(H,12,13);2*1-2H3/b11-7+;;
InChIKeyGNGZRRIEEGUINH-FCVAESPPSA-N
MW253.39 g/mol
LogP3.88
Rot. Bonds3

About ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine

ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine (PubChem CID 176566621) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine.

Molecular Properties

Compound Nameethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine
PubChem CID176566621
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Nameethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine
SMILESCC.CC.[H]/N=C(\C)c1c(NC)cc(C)nc1OC
InChIInChI=1S/C10H15N3O.2C2H6/c1-6-5-8(12-3)9(7(2)11)10(13-6)14-4;2*1-2/h5,11H,1-4H3,(H,12,13);2*1-2H3/b11-7+;;
InChIKeyGNGZRRIEEGUINH-FCVAESPPSA-N
XLogP3.88
TPSA58.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2,6-dimethyl-4-(methylamino)pyridine-3-carboximidamide
CID 81052045
3-ethanimidoyl-2-N,4-N-dimethylpyridine-2,4-diamine
CID 166807042
4-acetyl-2-methoxy-6-methylpyridine-3-carboxamide
CID 130017235
4,5-dichloro-2-ethanimidoyl-N-methylaniline;ethane
CID 144540373
2-methoxy-6-methyl-4-(trifluoromethyl)pyridine-3-carboxylic acid
CID 82389554
ethane;2-ethanimidoyl-N-ethyl-3-fluoro-5-methylaniline
CID 176566452
ethane;methyl N-(2-ethanimidoyl-3-fluoro-5-methylphenyl)carbamate
CID 176566890
4-ethanimidoyl-N-methyl-6-(4-methyl-2-pyridinyl)pyridin-3-amine
CID 134289638
1-(4,5-dimethyl-2-pyridinyl)ethanimine
CID 144541675
5-tert-butyl-2-ethanimidoyl-N-methylaniline;ethane
CID 144540330
4-methoxy-2,6-dimethylpyridine-3-carboximidamide
CID 81052054
3-ethanimidoyl-4-(methylamino)benzaldehyde
CID 171520476

Frequently Asked Questions

What is the IUPAC name of ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine?
The IUPAC name of ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine (CID 176566621) is ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine.
What is the SMILES notation for ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine?
The canonical SMILES for ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine is CC.CC.[H]/N=C(\C)c1c(NC)cc(C)nc1OC.
What is the InChIKey of ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine?
The InChIKey is GNGZRRIEEGUINH-FCVAESPPSA-N. The full InChI is InChI=1S/C10H15N3O.2C2H6/c1-6-5-8(12-3)9(7(2)11)10(13-6)14-4;2*1-2/h5,11H,1-4H3,(H,12,13);2*1-2H3/b11-7+;;.
What are the key properties of ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine?
ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine has a molecular weight of 253.39 g/mol, XLogP of 3.88, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethanimidoyl-2-methoxy-N,6-dimethylpyridin-4-amine is sourced from PubChem (CID 176566621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).