4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide

C16H19N3O — CID 51192997

IUPAC4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide
SMILESCC(NC(=O)c1ccc(N(C)C)cc1)c1cccnc1
InChIInChI=1S/C16H19N3O/c1-12(14-5-4-10-17-11-14)18-16(20)13-6-8-15(9-7-13)19(2)3/h4-12H,1-3H3,(H,18,20)
InChIKeyLTOHNQCZWRQHGP-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.64
Rot. Bonds4

About 4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide

4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide (PubChem CID 51192997) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide
PubChem CID51192997
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide
SMILESCC(NC(=O)c1ccc(N(C)C)cc1)c1cccnc1
InChIInChI=1S/C16H19N3O/c1-12(14-5-4-10-17-11-14)18-16(20)13-6-8-15(9-7-13)19(2)3/h4-12H,1-3H3,(H,18,20)
InChIKeyLTOHNQCZWRQHGP-UHFFFAOYSA-N
XLogP2.64
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 51073131
4-fluoro-N-(1-pyridin-3-ylethyl)benzamide
CID 18162974
4-bromo-N-(1-pyridin-3-ylethyl)benzamide
CID 18162969
3,4-difluoro-N-(1-pyridin-3-ylethyl)benzamide
CID 110724487
6-fluoro-N-(1-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 63971799
4-[[ethyl(propan-2-yl)amino]methyl]-N-[(1S)-1-pyridin-3-ylethyl]benzamide
CID 94822134
4-hydrazinyl-3-methyl-N-(1-pyridin-3-ylethyl)benzamide
CID 63212800
N-[(1S)-1-(3-chlorophenyl)ethyl]-4-(dimethylamino)benzamide
CID 27769378
3-(1-pyridin-3-ylethylcarbamoyl)benzoic acid
CID 43523910
N'-[4-(dimethylamino)benzoyl]pyridine-3-carbohydrazide
CID 25342800
4-(ethylsulfamoyl)-N-(1-pyridin-3-ylethyl)benzamide
CID 51193149
4-(phenoxymethyl)-N-[(1R)-1-pyridin-3-ylethyl]benzamide
CID 39952477

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide?
The IUPAC name of 4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide (CID 51192997) is 4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide?
The canonical SMILES for 4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide is CC(NC(=O)c1ccc(N(C)C)cc1)c1cccnc1.
What is the InChIKey of 4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide?
The InChIKey is LTOHNQCZWRQHGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-12(14-5-4-10-17-11-14)18-16(20)13-6-8-15(9-7-13)19(2)3/h4-12H,1-3H3,(H,18,20).
What are the key properties of 4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide?
4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide has a molecular weight of 269.35 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(1-pyridin-3-ylethyl)benzamide is sourced from PubChem (CID 51192997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).