N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide

C12H19N3O — CID 110483041

IUPACN-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)N(C)CCN(C)C)n1
InChIInChI=1S/C12H19N3O/c1-10-6-5-7-11(13-10)12(16)15(4)9-8-14(2)3/h5-7H,8-9H2,1-4H3
InChIKeyBTYZVPZYYQESAZ-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.02
Rot. Bonds4

About N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide

N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide (PubChem CID 110483041) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide
PubChem CID110483041
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)N(C)CCN(C)C)n1
InChIInChI=1S/C12H19N3O/c1-10-6-5-7-11(13-10)12(16)15(4)9-8-14(2)3/h5-7H,8-9H2,1-4H3
InChIKeyBTYZVPZYYQESAZ-UHFFFAOYSA-N
XLogP1.02
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide (CID 110483041) is N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide is Cc1cccc(C(=O)N(C)CCN(C)C)n1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide?
The InChIKey is BTYZVPZYYQESAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-10-6-5-7-11(13-10)12(16)15(4)9-8-14(2)3/h5-7H,8-9H2,1-4H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide?
N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 1.02, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 110483041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).