N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide

C15H17N3O — CID 115268424

IUPACN-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide
SMILESCc1ccc(C(=O)N(C)c2ccc(N)nc2)cc1C
InChIInChI=1S/C15H17N3O/c1-10-4-5-12(8-11(10)2)15(19)18(3)13-6-7-14(16)17-9-13/h4-9H,1-3H3,(H2,16,17)
InChIKeyLGEWWQNDZGCRLC-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.56
Rot. Bonds2

About N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide

N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide (PubChem CID 115268424) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide
PubChem CID115268424
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide
SMILESCc1ccc(C(=O)N(C)c2ccc(N)nc2)cc1C
InChIInChI=1S/C15H17N3O/c1-10-4-5-12(8-11(10)2)15(19)18(3)13-6-7-14(16)17-9-13/h4-9H,1-3H3,(H2,16,17)
InChIKeyLGEWWQNDZGCRLC-UHFFFAOYSA-N
XLogP2.56
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-amino-3-pyridinyl)-4-fluoro-N-methylbenzamide
CID 115268417
N-(6-amino-3-pyridinyl)-N-methyl-2,3-dihydro-1-benzofuran-5-carboxamide
CID 115274571
N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide
CID 62899740
6-amino-N-methyl-N-pyridin-4-ylpyridine-3-carboxamide
CID 106937214
N-[3-[(6-amino-3-pyridinyl)amino]propyl]-3,4-dimethylbenzamide
CID 82331662
methyl N-(6-amino-3-pyridinyl)-N-methylcarbamate
CID 115268442
N-(6-amino-3-pyridinyl)-N-methyl-1H-pyrrole-2-carboxamide
CID 115274565
3-amino-N,4-dimethyl-N-phenylbenzamide
CID 16771335
N-(6-amino-3-pyridinyl)-N-methylbutanamide
CID 115268400
N-(6-amino-3-pyridinyl)-N-methyl-1H-indole-3-carboxamide
CID 115274564
2-[(6-amino-3-pyridinyl)-methylamino]ethylcarbamic acid
CID 154385194
N-(6-amino-3-pyridinyl)-N-methyl-3-(2-methylphenyl)propanamide
CID 115274616

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide (CID 115268424) is N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide is Cc1ccc(C(=O)N(C)c2ccc(N)nc2)cc1C.
What is the InChIKey of N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide?
The InChIKey is LGEWWQNDZGCRLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-10-4-5-12(8-11(10)2)15(19)18(3)13-6-7-14(16)17-9-13/h4-9H,1-3H3,(H2,16,17).
What are the key properties of N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide?
N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide has a molecular weight of 255.32 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide is sourced from PubChem (CID 115268424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).