(3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone

C14H21N3O2 — CID 102745609

IUPAC(3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
SMILESCC1(C)CN(C(=O)c2ccncc2N)CC(C)(C)O1
InChIInChI=1S/C14H21N3O2/c1-13(2)8-17(9-14(3,4)19-13)12(18)10-5-6-16-7-11(10)15/h5-7H,8-9,15H2,1-4H3
InChIKeyDOVVQPCGSAIVHP-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.69
Rot. Bonds1

About (3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone

(3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone (PubChem CID 102745609) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is (3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
PubChem CID102745609
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name(3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
SMILESCC1(C)CN(C(=O)c2ccncc2N)CC(C)(C)O1
InChIInChI=1S/C14H21N3O2/c1-13(2)8-17(9-14(3,4)19-13)12(18)10-5-6-16-7-11(10)15/h5-7H,8-9,15H2,1-4H3
InChIKeyDOVVQPCGSAIVHP-UHFFFAOYSA-N
XLogP1.69
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
The IUPAC name of (3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone (CID 102745609) is (3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone.
What is the SMILES notation for (3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
The canonical SMILES for (3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone is CC1(C)CN(C(=O)c2ccncc2N)CC(C)(C)O1.
What is the InChIKey of (3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
The InChIKey is DOVVQPCGSAIVHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-13(2)8-17(9-14(3,4)19-13)12(18)10-5-6-16-7-11(10)15/h5-7H,8-9,15H2,1-4H3.
What are the key properties of (3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
(3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone has a molecular weight of 263.34 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone is sourced from PubChem (CID 102745609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).