5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide

C15H24N4O2 — CID 109223173

IUPAC5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide
SMILESCC(C)NC(=O)c1cncc(NCCN2CCOCC2)c1
InChIInChI=1S/C15H24N4O2/c1-12(2)18-15(20)13-9-14(11-16-10-13)17-3-4-19-5-7-21-8-6-19/h9-12,17H,3-8H2,1-2H3,(H,18,20)
InChIKeyWVCFKOFVPWQQNU-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.96
Rot. Bonds6

About 5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide

5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide (PubChem CID 109223173) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide
PubChem CID109223173
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide
SMILESCC(C)NC(=O)c1cncc(NCCN2CCOCC2)c1
InChIInChI=1S/C15H24N4O2/c1-12(2)18-15(20)13-9-14(11-16-10-13)17-3-4-19-5-7-21-8-6-19/h9-12,17H,3-8H2,1-2H3,(H,18,20)
InChIKeyWVCFKOFVPWQQNU-UHFFFAOYSA-N
XLogP0.96
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of 5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide (CID 109223173) is 5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for 5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide is CC(C)NC(=O)c1cncc(NCCN2CCOCC2)c1.
What is the InChIKey of 5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide?
The InChIKey is WVCFKOFVPWQQNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-12(2)18-15(20)13-9-14(11-16-10-13)17-3-4-19-5-7-21-8-6-19/h9-12,17H,3-8H2,1-2H3,(H,18,20).
What are the key properties of 5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide?
5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 0.96, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 109223173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).