6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide

C20H25N3O — CID 126796452

IUPAC6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide
SMILESCN(C)Cc1ccc(C(=O)N(C)C2CCc3ccccc3C2)cn1
InChIInChI=1S/C20H25N3O/c1-22(2)14-18-10-8-17(13-21-18)20(24)23(3)19-11-9-15-6-4-5-7-16(15)12-19/h4-8,10,13,19H,9,11-12,14H2,1-3H3
InChIKeyYHDAVISVNDCRMN-UHFFFAOYSA-N
MW323.44 g/mol
LogP2.77
Rot. Bonds4

About 6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide

6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide (PubChem CID 126796452) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is 6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide
PubChem CID126796452
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC Name6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide
SMILESCN(C)Cc1ccc(C(=O)N(C)C2CCc3ccccc3C2)cn1
InChIInChI=1S/C20H25N3O/c1-22(2)14-18-10-8-17(13-21-18)20(24)23(3)19-11-9-15-6-4-5-7-16(15)12-19/h4-8,10,13,19H,9,11-12,14H2,1-3H3
InChIKeyYHDAVISVNDCRMN-UHFFFAOYSA-N
XLogP2.77
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide?
The IUPAC name of 6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide (CID 126796452) is 6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide is CN(C)Cc1ccc(C(=O)N(C)C2CCc3ccccc3C2)cn1.
What is the InChIKey of 6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide?
The InChIKey is YHDAVISVNDCRMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-22(2)14-18-10-8-17(13-21-18)20(24)23(3)19-11-9-15-6-4-5-7-16(15)12-19/h4-8,10,13,19H,9,11-12,14H2,1-3H3.
What are the key properties of 6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide?
6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide has a molecular weight of 323.44 g/mol, XLogP of 2.77, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(dimethylamino)methyl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 126796452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).