4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide

C15H18N4O — CID 81242281

IUPAC4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESCCNc1ccncc1C(=O)N(C)Cc1ccncc1
InChIInChI=1S/C15H18N4O/c1-3-18-14-6-9-17-10-13(14)15(20)19(2)11-12-4-7-16-8-5-12/h4-10H,3,11H2,1-2H3,(H,17,18)
InChIKeyFHXJVIBMHDIZAJ-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.18
Rot. Bonds5

About 4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide

4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide (PubChem CID 81242281) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
PubChem CID81242281
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESCCNc1ccncc1C(=O)N(C)Cc1ccncc1
InChIInChI=1S/C15H18N4O/c1-3-18-14-6-9-17-10-13(14)15(20)19(2)11-12-4-7-16-8-5-12/h4-10H,3,11H2,1-2H3,(H,17,18)
InChIKeyFHXJVIBMHDIZAJ-UHFFFAOYSA-N
XLogP2.18
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-bromophenyl)methyl]-4-(ethylamino)-N-methylpyridine-3-carboxamide
CID 81238819
4-(ethylamino)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
CID 81240912
N-[(4-chlorophenyl)methyl]-3-(ethylamino)-N-methylpyridine-4-carboxamide
CID 105069615
4-(ethylamino)-N-methyl-N-(3-methylsulfanylpropyl)pyridine-3-carboxamide
CID 114238290
N-[(4-methoxyphenyl)methyl]-N-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81237935
4-(ethylamino)-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide
CID 81241438
4-(ethylamino)-N-methyl-N-(4-methylphenyl)pyridine-3-carboxamide
CID 81242334
3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide
CID 105068562
N-[2-(dimethylamino)ethyl]-4-(ethylamino)pyridine-3-carboxamide
CID 81236873
4-(ethylamino)-N-methyl-N-pyridin-2-ylpyridine-3-carboxamide
CID 81234678
4-chloro-N-[(4-ethylphenyl)methyl]-N-methylpyridine-3-carboxamide
CID 81225270
4-(ethylamino)-N-methyl-N-(oxan-4-yl)pyridine-3-carboxamide
CID 81243241

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide (CID 81242281) is 4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide is CCNc1ccncc1C(=O)N(C)Cc1ccncc1.
What is the InChIKey of 4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The InChIKey is FHXJVIBMHDIZAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-3-18-14-6-9-17-10-13(14)15(20)19(2)11-12-4-7-16-8-5-12/h4-10H,3,11H2,1-2H3,(H,17,18).
What are the key properties of 4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 81242281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).