N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide

C15H17N3O — CID 106910118

IUPACN-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide
SMILESCCNCc1ccc(NC(=O)c2ccncc2)cc1
InChIInChI=1S/C15H17N3O/c1-2-16-11-12-3-5-14(6-4-12)18-15(19)13-7-9-17-10-8-13/h3-10,16H,2,11H2,1H3,(H,18,19)
InChIKeySIDFXRRARSQNBO-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.44
Rot. Bonds5

About N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide

N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide (PubChem CID 106910118) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide
PubChem CID106910118
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide
SMILESCCNCc1ccc(NC(=O)c2ccncc2)cc1
InChIInChI=1S/C15H17N3O/c1-2-16-11-12-3-5-14(6-4-12)18-15(19)13-7-9-17-10-8-13/h3-10,16H,2,11H2,1H3,(H,18,19)
InChIKeySIDFXRRARSQNBO-UHFFFAOYSA-N
XLogP2.44
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cobalt;N-pyridin-4-yl-4-[[[4-(pyridin-4-ylcarbamoyl)phenyl]methylamino]methyl]benzamide
CID 59994750
N-(4-methylphenyl)pyridine-4-carboxamide;propane
CID 142028273
4-ethyl-N-pyridin-4-ylbenzamide
CID 2712552
methanol;N-pyridin-4-ylpyridine-4-carboxamide
CID 158472241
N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide
CID 106910201
N-[[4-[(4-fluorophenyl)carbamoyl]phenyl]methyl]pyridine-4-carboxamide
CID 71918325
N-[4-(ethylaminomethyl)phenyl]pyridine-2-carboxamide
CID 106910172
4-N-(4-methylphenyl)-1-N-(pyridin-4-ylmethyl)benzene-1,4-dicarboxamide
CID 109047754
N-[4-[4-[2-(benzylamino)ethyl]phenoxy]phenyl]pyridine-4-carboxamide
CID 11597008
N-[4-[[[4-[[ethyl(propan-2-yl)amino]methyl]benzoyl]amino]methyl]phenyl]pyridine-4-carboxamide
CID 86878011
N-[4-[[(6-methylpyrimidin-4-yl)amino]methyl]phenyl]pyridine-4-carboxamide
CID 133300375
4-(aminomethyl)-N-pyridin-4-ylbenzamide
CID 16771252

Frequently Asked Questions

What is the IUPAC name of N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide?
The IUPAC name of N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide (CID 106910118) is N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide?
The canonical SMILES for N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide is CCNCc1ccc(NC(=O)c2ccncc2)cc1.
What is the InChIKey of N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide?
The InChIKey is SIDFXRRARSQNBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-2-16-11-12-3-5-14(6-4-12)18-15(19)13-7-9-17-10-8-13/h3-10,16H,2,11H2,1H3,(H,18,19).
What are the key properties of N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide?
N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 106910118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).