N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide

C16H27N5O2 — CID 109153848

IUPACN-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
SMILESCN(C)CCNC(=O)c1ccc(NCCN2CCOCC2)nc1
InChIInChI=1S/C16H27N5O2/c1-20(2)7-5-18-16(22)14-3-4-15(19-13-14)17-6-8-21-9-11-23-12-10-21/h3-4,13H,5-12H2,1-2H3,(H,17,19)(H,18,22)
InChIKeyRIGZWEATTNDAPJ-UHFFFAOYSA-N
MW321.43 g/mol
LogP0.12
Rot. Bonds8

About N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide

N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide (PubChem CID 109153848) has the molecular formula C16H27N5O2 and a molecular weight of 321.43 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
PubChem CID109153848
Molecular FormulaC16H27N5O2
Molecular Weight321.43 g/mol
Exact Mass321.22
IUPAC NameN-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
SMILESCN(C)CCNC(=O)c1ccc(NCCN2CCOCC2)nc1
InChIInChI=1S/C16H27N5O2/c1-20(2)7-5-18-16(22)14-3-4-15(19-13-14)17-6-8-21-9-11-23-12-10-21/h3-4,13H,5-12H2,1-2H3,(H,17,19)(H,18,22)
InChIKeyRIGZWEATTNDAPJ-UHFFFAOYSA-N
XLogP0.12
TPSA69.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide (CID 109153848) is N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide is CN(C)CCNC(=O)c1ccc(NCCN2CCOCC2)nc1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide?
The InChIKey is RIGZWEATTNDAPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N5O2/c1-20(2)7-5-18-16(22)14-3-4-15(19-13-14)17-6-8-21-9-11-23-12-10-21/h3-4,13H,5-12H2,1-2H3,(H,17,19)(H,18,22).
What are the key properties of N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide?
N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide has a molecular weight of 321.43 g/mol, XLogP of 0.12, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109153848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).