ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine

C13H27N3O — CID 142345276

IUPACethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine
SMILESCC.CCNC=O.CNC1=CC(C)=CN(C)C1
InChIInChI=1S/C8H14N2.C3H7NO.C2H6/c1-7-4-8(9-2)6-10(3)5-7;1-2-4-3-5;1-2/h4-5,9H,6H2,1-3H3;3H,2H2,1H3,(H,4,5);1-2H3
InChIKeyQXDJXGWZCMATEB-UHFFFAOYSA-N
MW241.38 g/mol
LogP1.72
Rot. Bonds3

About ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine

ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine (PubChem CID 142345276) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine.

Molecular Properties

Compound Nameethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine
PubChem CID142345276
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Nameethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine
SMILESCC.CCNC=O.CNC1=CC(C)=CN(C)C1
InChIInChI=1S/C8H14N2.C3H7NO.C2H6/c1-7-4-8(9-2)6-10(3)5-7;1-2-4-3-5;1-2/h4-5,9H,6H2,1-3H3;3H,2H2,1H3,(H,4,5);1-2H3
InChIKeyQXDJXGWZCMATEB-UHFFFAOYSA-N
XLogP1.72
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1Z,3E,5Z)-3-[[(2R)-2-aminopropyl]amino]-1-fluoro-5-methylhepta-1,3,5-trien-2-yl]formamide
CID 144684463
N-(1,5-dimethyl-2H-pyridin-3-yl)acetamide
CID 57076374
N-[(6-methyl-4-methylidene-1H-pyridin-3-yl)methyl]formamide
CID 57194411
N-(1,5-diethyl-2-methyl-2H-pyridin-3-yl)formamide
CID 57234254
N-(1,5-diethyl-2H-pyridin-3-yl)acetamide
CID 57310396
N-(6-amino-4,5-dimethylhexa-2,4-dien-2-yl)formamide
CID 123444825
N-[(1E,4Z)-5-aminohexa-1,4-dienyl]-N-[2-(ethylamino)ethyl]formamide
CID 134406426
N-(1,6-dimethyl-2H-pyridin-3-yl)-N-[2-(methylamino)ethyl]formamide
CID 134406631
N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide
CID 134406682
N-[2-(ethylamino)ethyl]-N-[(3E,5Z)-6-(methylamino)hepta-3,5-dien-3-yl]formamide
CID 134406787
N-[(1E,3Z,6Z,8Z)-2-amino-6-ethenyldeca-1,3,6,8-tetraenyl]formamide
CID 134502576
N-[(2Z,4E)-6-amino-4,5-dimethylhexa-2,4-dien-2-yl]formamide
CID 134525628

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine?
The IUPAC name of ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine (CID 142345276) is ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine.
What is the SMILES notation for ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine?
The canonical SMILES for ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine is CC.CCNC=O.CNC1=CC(C)=CN(C)C1.
What is the InChIKey of ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine?
The InChIKey is QXDJXGWZCMATEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2.C3H7NO.C2H6/c1-7-4-8(9-2)6-10(3)5-7;1-2-4-3-5;1-2/h4-5,9H,6H2,1-3H3;3H,2H2,1H3,(H,4,5);1-2H3.
What are the key properties of ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine?
ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine has a molecular weight of 241.38 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethylformamide;N,1,5-trimethyl-2H-pyridin-3-amine is sourced from PubChem (CID 142345276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).