5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide

C15H25N5O2 — CID 126961674

IUPAC5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide
SMILESCCN(CCN(C)C)C(=O)CNCc1cncc(C(N)=O)c1
InChIInChI=1S/C15H25N5O2/c1-4-20(6-5-19(2)3)14(21)11-18-9-12-7-13(15(16)22)10-17-8-12/h7-8,10,18H,4-6,9,11H2,1-3H3,(H2,16,22)
InChIKeyBSONZTJPFSPNIH-UHFFFAOYSA-N
MW307.40 g/mol
LogP-0.32
Rot. Bonds9

About 5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide

5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide (PubChem CID 126961674) has the molecular formula C15H25N5O2 and a molecular weight of 307.40 g/mol. Its IUPAC name is 5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide
PubChem CID126961674
Molecular FormulaC15H25N5O2
Molecular Weight307.40 g/mol
Exact Mass307.20
IUPAC Name5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide
SMILESCCN(CCN(C)C)C(=O)CNCc1cncc(C(N)=O)c1
InChIInChI=1S/C15H25N5O2/c1-4-20(6-5-19(2)3)14(21)11-18-9-12-7-13(15(16)22)10-17-8-12/h7-8,10,18H,4-6,9,11H2,1-3H3,(H2,16,22)
InChIKeyBSONZTJPFSPNIH-UHFFFAOYSA-N
XLogP-0.32
TPSA91.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide?
The IUPAC name of 5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide (CID 126961674) is 5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide is CCN(CCN(C)C)C(=O)CNCc1cncc(C(N)=O)c1.
What is the InChIKey of 5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide?
The InChIKey is BSONZTJPFSPNIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O2/c1-4-20(6-5-19(2)3)14(21)11-18-9-12-7-13(15(16)22)10-17-8-12/h7-8,10,18H,4-6,9,11H2,1-3H3,(H2,16,22).
What are the key properties of 5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide?
5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide has a molecular weight of 307.40 g/mol, XLogP of -0.32, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-3-carboxamide is sourced from PubChem (CID 126961674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).