6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide

C14H17N5 — CID 54943583

IUPAC6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N(C)CCc2ccncc2)nc1
InChIInChI=1S/C14H17N5/c1-19(9-6-11-4-7-17-8-5-11)13-3-2-12(10-18-13)14(15)16/h2-5,7-8,10H,6,9H2,1H3,(H3,15,16)
InChIKeySQGPWSWEOGRAPW-UHFFFAOYSA-N
MW255.33 g/mol
LogP1.44
Rot. Bonds5

About 6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide

6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide (PubChem CID 54943583) has the molecular formula C14H17N5 and a molecular weight of 255.33 g/mol. Its IUPAC name is 6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide.

Molecular Properties

Compound Name6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide
PubChem CID54943583
Molecular FormulaC14H17N5
Molecular Weight255.33 g/mol
Exact Mass255.15
IUPAC Name6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N(C)CCc2ccncc2)nc1
InChIInChI=1S/C14H17N5/c1-19(9-6-11-4-7-17-8-5-11)13-3-2-12(10-18-13)14(15)16/h2-5,7-8,10H,6,9H2,1H3,(H3,15,16)
InChIKeySQGPWSWEOGRAPW-UHFFFAOYSA-N
XLogP1.44
TPSA78.89 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.33
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide
CID 43563471
3-bromo-4-[methyl(2-pyridin-4-ylethyl)amino]benzenecarboximidamide
CID 82799848
6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-3-carboximidamide
CID 28799322
6-[cyclopropylmethyl(methyl)amino]pyridine-3-carboximidamide
CID 60985659
N-[2-(dimethylamino)ethyl]-6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboxamide
CID 109153874
6-[cyclobutylmethyl(methyl)amino]pyridine-3-carboximidamide
CID 62860621
6-[methyl(2-pyridin-4-ylethyl)amino]-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109158287
6-(aminomethyl)-N-methyl-N-(2-pyridin-4-ylethyl)pyridazin-3-amine
CID 62285835
N-[4-(dimethylamino)phenyl]-6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboxamide
CID 109159164
N-methyl-5-(methylaminomethyl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine
CID 62284014
N-(2-fluorophenyl)-6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboxamide
CID 109159133
5-chloro-2-[methyl(2-pyridin-4-ylethyl)amino]benzenecarboximidamide
CID 62493585

Frequently Asked Questions

What is the IUPAC name of 6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide?
The IUPAC name of 6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide (CID 54943583) is 6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide.
What is the SMILES notation for 6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide?
The canonical SMILES for 6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(N(C)CCc2ccncc2)nc1.
What is the InChIKey of 6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide?
The InChIKey is SQGPWSWEOGRAPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5/c1-19(9-6-11-4-7-17-8-5-11)13-3-2-12(10-18-13)14(15)16/h2-5,7-8,10H,6,9H2,1H3,(H3,15,16).
What are the key properties of 6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide?
6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide has a molecular weight of 255.33 g/mol, XLogP of 1.44, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide is sourced from PubChem (CID 54943583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).