N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide

C16H19N3O — CID 91804668

IUPACN-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide
SMILESCN(C)CCNC(=O)c1ccncc1-c1ccccc1
InChIInChI=1S/C16H19N3O/c1-19(2)11-10-18-16(20)14-8-9-17-12-15(14)13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H,18,20)
InChIKeyIOYYLKGQOGYFBI-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.04
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide

N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide (PubChem CID 91804668) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide
PubChem CID91804668
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide
SMILESCN(C)CCNC(=O)c1ccncc1-c1ccccc1
InChIInChI=1S/C16H19N3O/c1-19(2)11-10-18-16(20)14-8-9-17-12-15(14)13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H,18,20)
InChIKeyIOYYLKGQOGYFBI-UHFFFAOYSA-N
XLogP2.04
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[2-(dimethylamino)ethyl]pyridine-4-carboxamide
CID 110849614
2-[2-(dimethylamino)ethylcarbamoyl]-6-phenylbenzoic acid
CID 123504584
N-[2-(dimethylamino)ethyl]-5-phenylacridine-4-carboxamide
CID 10690459
N-[2-(dimethylamino)ethyl]-4-(ethylamino)pyridine-3-carboxamide
CID 81236873
3-methyl-N-[2-(2-phenylphenyl)ethyl]pyridine-4-carboxamide
CID 91120508
3-(3-aminoprop-1-ynyl)-N-[2-(dimethylamino)ethyl]pyridine-4-carboxamide
CID 66481909
N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide
CID 70144629
4-chloro-N-[2-(N-methylanilino)ethyl]pyridine-3-carboxamide
CID 81225507
2-[2-[2-(dimethylamino)ethylcarbamoyl]phenyl]acetic acid
CID 114199769
N-[2-(dimethylamino)ethyl]-2-methylsulfanyl-4-phenylpyrimidine-5-carboxamide
CID 20913631
N-[2-(dimethylamino)ethyl]-1,3-diphenylpyrazole-4-carboxamide
CID 42282105
N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide
CID 110408034

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide (CID 91804668) is N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide is CN(C)CCNC(=O)c1ccncc1-c1ccccc1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide?
The InChIKey is IOYYLKGQOGYFBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-19(2)11-10-18-16(20)14-8-9-17-12-15(14)13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H,18,20).
What are the key properties of N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide?
N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide is sourced from PubChem (CID 91804668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).