4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide

C12H15N5O2 — CID 103468954

IUPAC4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1c1ccc(N)c(C#N)n1
InChIInChI=1S/C12H15N5O2/c1-15-12(18)10-7-19-5-4-17(10)11-3-2-8(14)9(6-13)16-11/h2-3,10H,4-5,7,14H2,1H3,(H,15,18)
InChIKeyMISJHHQWZHZUQF-UHFFFAOYSA-N
MW261.28 g/mol
LogP-0.51
Rot. Bonds2

About 4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide

4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide (PubChem CID 103468954) has the molecular formula C12H15N5O2 and a molecular weight of 261.28 g/mol. Its IUPAC name is 4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide
PubChem CID103468954
Molecular FormulaC12H15N5O2
Molecular Weight261.28 g/mol
Exact Mass261.12
IUPAC Name4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1c1ccc(N)c(C#N)n1
InChIInChI=1S/C12H15N5O2/c1-15-12(18)10-7-19-5-4-17(10)11-3-2-8(14)9(6-13)16-11/h2-3,10H,4-5,7,14H2,1H3,(H,15,18)
InChIKeyMISJHHQWZHZUQF-UHFFFAOYSA-N
XLogP-0.51
TPSA104.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-(6-amino-5-nitro-2-pyridinyl)-N-methylmorpholine-3-carboxamide
CID 83105439
4-(4-cyano-6-methylpyrimidin-2-yl)-N-methylmorpholine-3-carboxamide
CID 107545051
4-(2-amino-5-bromophenyl)-N-methylmorpholine-3-carboxamide
CID 83107043
4-(3-cyano-4-methyl-2-pyridinyl)-N-methylmorpholine-3-carboxamide
CID 83099052
4-(6-amino-3-pyridinyl)-N-methylmorpholine-3-carboxamide
CID 83106485
4-(4,6-dichloro-1,3,5-triazin-2-yl)-N-methylmorpholine-3-carboxamide
CID 83103129
4-(5-amino-6-methoxy-2-pyridinyl)-N-ethylmorpholine-3-carboxamide
CID 83106690
1-(5-amino-6-cyano-2-pyridinyl)piperidine-2-carboxamide
CID 103467973
3-amino-4-[3-(methylcarbamoyl)morpholin-4-yl]benzoic acid
CID 83103492
4-(5-aminoquinolin-8-yl)-N-methylmorpholine-3-carboxamide
CID 83097175
4-(6-chloro-2-propan-2-ylpyrimidin-4-yl)-N-methylmorpholine-3-carboxamide
CID 83103056
4-(3-aminoquinolin-4-yl)-N-methylmorpholine-3-carboxamide
CID 103963546

Frequently Asked Questions

What is the IUPAC name of 4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide?
The IUPAC name of 4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide (CID 103468954) is 4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide.
What is the SMILES notation for 4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide?
The canonical SMILES for 4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide is CNC(=O)C1COCCN1c1ccc(N)c(C#N)n1.
What is the InChIKey of 4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide?
The InChIKey is MISJHHQWZHZUQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O2/c1-15-12(18)10-7-19-5-4-17(10)11-3-2-8(14)9(6-13)16-11/h2-3,10H,4-5,7,14H2,1H3,(H,15,18).
What are the key properties of 4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide?
4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide has a molecular weight of 261.28 g/mol, XLogP of -0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-amino-6-cyano-2-pyridinyl)-N-methylmorpholine-3-carboxamide is sourced from PubChem (CID 103468954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).