2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone

C11H14ClN3O2 — CID 164974271

IUPAC2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone
SMILESNCC(=O)c1cc(Cl)cc(N2CCOCC2)n1
InChIInChI=1S/C11H14ClN3O2/c12-8-5-9(10(16)7-13)14-11(6-8)15-1-3-17-4-2-15/h5-6H,1-4,7,13H2
InChIKeyXMYYCYBRVTVBBR-UHFFFAOYSA-N
MW255.70 g/mol
LogP0.71
Rot. Bonds3

About 2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone

2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone (PubChem CID 164974271) has the molecular formula C11H14ClN3O2 and a molecular weight of 255.70 g/mol. Its IUPAC name is 2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone.

Molecular Properties

Compound Name2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone
PubChem CID164974271
Molecular FormulaC11H14ClN3O2
Molecular Weight255.70 g/mol
Exact Mass255.08
IUPAC Name2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone
SMILESNCC(=O)c1cc(Cl)cc(N2CCOCC2)n1
InChIInChI=1S/C11H14ClN3O2/c12-8-5-9(10(16)7-13)14-11(6-8)15-1-3-17-4-2-15/h5-6H,1-4,7,13H2
InChIKeyXMYYCYBRVTVBBR-UHFFFAOYSA-N
XLogP0.71
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.70
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-1-(5-chloro-2-morpholin-4-ylphenyl)ethanone
CID 117390088
2-amino-1-(3-chloro-4-morpholin-4-ylphenyl)ethanone
CID 117390089
4-chloro-6-morpholin-4-ylpyridin-2-amine;cyclopropylboronic acid;4-cyclopropyl-6-morpholin-4-ylpyridin-2-amine
CID 163546274
2-(2-chloro-6-morpholin-4-ylpyrimidin-4-yl)ethanamine
CID 83852725
N-[(4-chlorophenyl)methyl]-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365353
(3R)-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)-3-methylpyrrolidin-2-one
CID 161185733
6-morpholin-4-ylpyridine-2-carbohydrazide
CID 67450200
(4-chlorophenyl)-[4-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]methanone
CID 46267909
N-(2,4-dichlorophenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365493
2-chloro-6-(1,4-oxazepan-4-yl)pyridine-4-carboxylic acid
CID 55139980
2-(4,6-dimorpholin-4-ylpyrimidin-2-yl)sulfanylacetic acid
CID 23993191
2,6-dimorpholin-4-ylpyrimidine-4-carboxylate
CID 6989309

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone?
The IUPAC name of 2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone (CID 164974271) is 2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone.
What is the SMILES notation for 2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone?
The canonical SMILES for 2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone is NCC(=O)c1cc(Cl)cc(N2CCOCC2)n1.
What is the InChIKey of 2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone?
The InChIKey is XMYYCYBRVTVBBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O2/c12-8-5-9(10(16)7-13)14-11(6-8)15-1-3-17-4-2-15/h5-6H,1-4,7,13H2.
What are the key properties of 2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone?
2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone has a molecular weight of 255.70 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(4-chloro-6-morpholin-4-yl-2-pyridinyl)ethanone is sourced from PubChem (CID 164974271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).