(6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone

C12H16ClN3O2 — CID 62155508

IUPAC(6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone
SMILESCCC1CN(C(=O)c2nc(N)ccc2Cl)CCO1
InChIInChI=1S/C12H16ClN3O2/c1-2-8-7-16(5-6-18-8)12(17)11-9(13)3-4-10(14)15-11/h3-4,8H,2,5-7H2,1H3,(H2,14,15)
InChIKeyUOFBSBSKMHLFTF-UHFFFAOYSA-N
MW269.73 g/mol
LogP1.57
Rot. Bonds2

About (6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone

(6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone (PubChem CID 62155508) has the molecular formula C12H16ClN3O2 and a molecular weight of 269.73 g/mol. Its IUPAC name is (6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone
PubChem CID62155508
Molecular FormulaC12H16ClN3O2
Molecular Weight269.73 g/mol
Exact Mass269.09
IUPAC Name(6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone
SMILESCCC1CN(C(=O)c2nc(N)ccc2Cl)CCO1
InChIInChI=1S/C12H16ClN3O2/c1-2-8-7-16(5-6-18-8)12(17)11-9(13)3-4-10(14)15-11/h3-4,8H,2,5-7H2,1H3,(H2,14,15)
InChIKeyUOFBSBSKMHLFTF-UHFFFAOYSA-N
XLogP1.57
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
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

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Related Compounds

(5-amino-2-chlorophenyl)-(2-ethylmorpholin-4-yl)methanone
CID 43562207
(4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone
CID 63375773
(4-amino-1-methylpyrazol-3-yl)-(2-ethylmorpholin-4-yl)methanone
CID 65354771
(6-chloropyridazin-3-yl)-(2-ethylmorpholin-4-yl)methanone
CID 60857887
(5-amino-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone
CID 81317078
(5-chloro-2-fluorophenyl)-(2-ethylmorpholin-4-yl)methanone
CID 60733638
(2-amino-5-bromo-4-pyridinyl)-(2-ethylmorpholin-4-yl)methanone
CID 114193900
2-ethylmorpholine-4-carboxylic acid
CID 121455686
4-chloro-3-(2-ethylmorpholine-4-carbonyl)-N,N-dimethylbenzenesulfonamide
CID 43070690
(2-ethylmorpholin-4-yl)-(4-sulfanylphenyl)methanone
CID 107023047
(2-amino-5-fluorophenyl)-(2-ethylmorpholin-4-yl)methanone
CID 43562755
(2-ethylmorpholin-4-yl)-(6-hydrazinylpyridazin-3-yl)methanone
CID 62243410

Frequently Asked Questions

What is the IUPAC name of (6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone?
The IUPAC name of (6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone (CID 62155508) is (6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone.
What is the SMILES notation for (6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone?
The canonical SMILES for (6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone is CCC1CN(C(=O)c2nc(N)ccc2Cl)CCO1.
What is the InChIKey of (6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone?
The InChIKey is UOFBSBSKMHLFTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN3O2/c1-2-8-7-16(5-6-18-8)12(17)11-9(13)3-4-10(14)15-11/h3-4,8H,2,5-7H2,1H3,(H2,14,15).
What are the key properties of (6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone?
(6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone has a molecular weight of 269.73 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone is sourced from PubChem (CID 62155508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).