N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide

C10H17N3O — CID 134406682

IUPACN-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide
SMILESCNCCN(C=O)C1=CC=C(C)NC1
InChIInChI=1S/C10H17N3O/c1-9-3-4-10(7-12-9)13(8-14)6-5-11-2/h3-4,8,11-12H,5-7H2,1-2H3
InChIKeyGLCCBADDVHCSAB-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.06
Rot. Bonds5

About N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide

N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide (PubChem CID 134406682) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide.

Molecular Properties

Compound NameN-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide
PubChem CID134406682
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC NameN-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide
SMILESCNCCN(C=O)C1=CC=C(C)NC1
InChIInChI=1S/C10H17N3O/c1-9-3-4-10(7-12-9)13(8-14)6-5-11-2/h3-4,8,11-12H,5-7H2,1-2H3
InChIKeyGLCCBADDVHCSAB-UHFFFAOYSA-N
XLogP0.06
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide?
The IUPAC name of N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide (CID 134406682) is N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide.
What is the SMILES notation for N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide?
The canonical SMILES for N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide is CNCCN(C=O)C1=CC=C(C)NC1.
What is the InChIKey of N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide?
The InChIKey is GLCCBADDVHCSAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-9-3-4-10(7-12-9)13(8-14)6-5-11-2/h3-4,8,11-12H,5-7H2,1-2H3.
What are the key properties of N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide?
N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide has a molecular weight of 195.27 g/mol, XLogP of 0.06, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)ethyl]-N-(6-methyl-1,2-dihydropyridin-3-yl)formamide is sourced from PubChem (CID 134406682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).