(2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone

C12H16ClN3O2 — CID 62154515

IUPAC(2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone
SMILESCC1CN(C(=O)c2cc(N)nc(Cl)c2)CC(C)O1
InChIInChI=1S/C12H16ClN3O2/c1-7-5-16(6-8(2)18-7)12(17)9-3-10(13)15-11(14)4-9/h3-4,7-8H,5-6H2,1-2H3,(H2,14,15)
InChIKeySZOXDBIPYDNQLD-UHFFFAOYSA-N
MW269.73 g/mol
LogP1.57
Rot. Bonds1

About (2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone

(2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone (PubChem CID 62154515) has the molecular formula C12H16ClN3O2 and a molecular weight of 269.73 g/mol. Its IUPAC name is (2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone
PubChem CID62154515
Molecular FormulaC12H16ClN3O2
Molecular Weight269.73 g/mol
Exact Mass269.09
IUPAC Name(2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone
SMILESCC1CN(C(=O)c2cc(N)nc(Cl)c2)CC(C)O1
InChIInChI=1S/C12H16ClN3O2/c1-7-5-16(6-8(2)18-7)12(17)9-3-10(13)15-11(14)4-9/h3-4,7-8H,5-6H2,1-2H3,(H2,14,15)
InChIKeySZOXDBIPYDNQLD-UHFFFAOYSA-N
XLogP1.57
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.73
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

(2-amino-6-chloro-4-pyridinyl)-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]methanone
CID 102936186
(2-amino-6-chloro-4-pyridinyl)-(3,4-dimethoxypyrrolidin-1-yl)methanone
CID 103538513
(2-amino-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 55043295
(2-amino-6-chloro-4-pyridinyl)-pyrrolidin-1-ylmethanone
CID 62156377
(2-amino-6-chloro-4-pyridinyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
CID 102737678
(3,4-dichlorophenyl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 3339174
(3,4-dichlorophenyl)-[(2S,6S)-2,6-dimethylmorpholin-4-yl]methanone
CID 7724523
(3,4-dichlorophenyl)-[(2R,6R)-2,6-dimethylmorpholin-4-yl]methanone
CID 7722716
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 618918
(2-amino-6-chloro-4-pyridinyl)-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)methanone
CID 81200537
(3-amino-5-fluoro-4-methylphenyl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 60862183
(3-chloro-4-methylphenyl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 143211757

Frequently Asked Questions

What is the IUPAC name of (2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone?
The IUPAC name of (2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone (CID 62154515) is (2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone.
What is the SMILES notation for (2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone?
The canonical SMILES for (2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone is CC1CN(C(=O)c2cc(N)nc(Cl)c2)CC(C)O1.
What is the InChIKey of (2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone?
The InChIKey is SZOXDBIPYDNQLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN3O2/c1-7-5-16(6-8(2)18-7)12(17)9-3-10(13)15-11(14)4-9/h3-4,7-8H,5-6H2,1-2H3,(H2,14,15).
What are the key properties of (2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone?
(2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone has a molecular weight of 269.73 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-6-chloro-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone is sourced from PubChem (CID 62154515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).