N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide

C19H24N4O2 — CID 109229643

IUPACN-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide
SMILESCN(C(=O)c1cncc(NCCN2CCOCC2)c1)c1ccccc1
InChIInChI=1S/C19H24N4O2/c1-22(18-5-3-2-4-6-18)19(24)16-13-17(15-20-14-16)21-7-8-23-9-11-25-12-10-23/h2-6,13-15,21H,7-12H2,1H3
InChIKeyUGUZOKOFWPYSTI-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.10
Rot. Bonds6

About N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide

N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide (PubChem CID 109229643) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide
PubChem CID109229643
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide
SMILESCN(C(=O)c1cncc(NCCN2CCOCC2)c1)c1ccccc1
InChIInChI=1S/C19H24N4O2/c1-22(18-5-3-2-4-6-18)19(24)16-13-17(15-20-14-16)21-7-8-23-9-11-25-12-10-23/h2-6,13-15,21H,7-12H2,1H3
InChIKeyUGUZOKOFWPYSTI-UHFFFAOYSA-N
XLogP2.10
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide?
The IUPAC name of N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide (CID 109229643) is N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide?
The canonical SMILES for N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide is CN(C(=O)c1cncc(NCCN2CCOCC2)c1)c1ccccc1.
What is the InChIKey of N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide?
The InChIKey is UGUZOKOFWPYSTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-22(18-5-3-2-4-6-18)19(24)16-13-17(15-20-14-16)21-7-8-23-9-11-25-12-10-23/h2-6,13-15,21H,7-12H2,1H3.
What are the key properties of N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide?
N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.10, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 109229643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).