N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide

C16H19N3O — CID 43734586

IUPACN,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide
SMILESCNC(=O)c1cccc(NC(C)c2cccnc2)c1C
InChIInChI=1S/C16H19N3O/c1-11-14(16(20)17-3)7-4-8-15(11)19-12(2)13-6-5-9-18-10-13/h4-10,12,19H,1-3H3,(H,17,20)
InChIKeyFNKBXVFJDIYCCF-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.92
Rot. Bonds4

About N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide

N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide (PubChem CID 43734586) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide.

Molecular Properties

Compound NameN,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide
PubChem CID43734586
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide
SMILESCNC(=O)c1cccc(NC(C)c2cccnc2)c1C
InChIInChI=1S/C16H19N3O/c1-11-14(16(20)17-3)7-4-8-15(11)19-12(2)13-6-5-9-18-10-13/h4-10,12,19H,1-3H3,(H,17,20)
InChIKeyFNKBXVFJDIYCCF-UHFFFAOYSA-N
XLogP2.92
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(1-pyridin-3-ylethylamino)benzamide
CID 43683661
3-amino-N-methyl-4-(1-pyridin-3-ylethylamino)benzamide
CID 82988367
N,2-dimethyl-3-[1-(5-methylfuran-2-yl)ethylamino]benzamide
CID 43734599
5-methyl-2-(1-pyridin-3-ylethylamino)benzoic acid
CID 62514651
1-methyl-3-(1-pyridin-3-ylethyl)urea
CID 115576611
2-fluoro-N-(1-pyridin-3-ylethyl)aniline
CID 43194891
2-hydroxy-N-(1-pyridin-3-ylethyl)benzamide
CID 43419974
N-methyl-2-[[(1S)-1-pyridin-3-ylethyl]amino]propanamide
CID 81404603
methyl 3-amino-2-(1-pyridin-3-ylethylamino)benzoate
CID 115934150
2-methyl-3-[1-(4-methylphenyl)ethylamino]benzoic acid
CID 43737323
3-[[(2R)-2-aminopropanoyl]amino]-N,2-dimethylbenzamide
CID 54996136
(1R)-N-methyl-1-pyridin-3-ylethanamine
CID 26248773

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide?
The IUPAC name of N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide (CID 43734586) is N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide.
What is the SMILES notation for N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide?
The canonical SMILES for N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide is CNC(=O)c1cccc(NC(C)c2cccnc2)c1C.
What is the InChIKey of N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide?
The InChIKey is FNKBXVFJDIYCCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-11-14(16(20)17-3)7-4-8-15(11)19-12(2)13-6-5-9-18-10-13/h4-10,12,19H,1-3H3,(H,17,20).
What are the key properties of N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide?
N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide has a molecular weight of 269.35 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-(1-pyridin-3-ylethylamino)benzamide is sourced from PubChem (CID 43734586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).