(2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone

C17H25N3O2 — CID 56813848

IUPAC(2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone
SMILESCC1(C)CN(C(=O)c2cccnc2N2CCCCC2)CCO1
InChIInChI=1S/C17H25N3O2/c1-17(2)13-20(11-12-22-17)16(21)14-7-6-8-18-15(14)19-9-4-3-5-10-19/h6-8H,3-5,9-13H2,1-2H3
InChIKeyPHFQLJHKLSOADD-UHFFFAOYSA-N
MW303.41 g/mol
LogP2.32
Rot. Bonds2

About (2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone

(2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone (PubChem CID 56813848) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is (2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone.

Molecular Properties

Compound Name(2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone
PubChem CID56813848
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC Name(2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone
SMILESCC1(C)CN(C(=O)c2cccnc2N2CCCCC2)CCO1
InChIInChI=1S/C17H25N3O2/c1-17(2)13-20(11-12-22-17)16(21)14-7-6-8-18-15(14)19-9-4-3-5-10-19/h6-8H,3-5,9-13H2,1-2H3
InChIKeyPHFQLJHKLSOADD-UHFFFAOYSA-N
XLogP2.32
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(2-piperidin-1-ylpyridine-3-carbonyl)-1,4-diazepan-1-yl]ethanone
CID 56813825
(2,2-dimethylmorpholin-4-yl)-(3-hydroxy-2-methylphenyl)methanone
CID 82793785
(3-methylpiperidin-1-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone
CID 84576155
[2-(azepan-1-yl)-3-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone
CID 84576964
oxazepan-2-yl-(2-piperidin-1-yl-3-pyridinyl)methanone
CID 122144453
(2,6-dimethylmorpholin-4-yl)-(2-pyrrolidin-1-yl-3-pyridinyl)methanone
CID 134016503
(3,5-dimethylpiperidin-1-yl)-(2-pyrrolidin-1-yl-3-pyridinyl)methanone
CID 84575076
(2-bromo-3-methylphenyl)-(2,2-dimethylmorpholin-4-yl)methanone
CID 67326501
[2-[(3R,4R)-3-hydroxy-3,4-dimethylpyrrolidin-1-yl]-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 72918907
2-pyrrolidin-1-ylpyridine-3-carboxylic acid
CID 2794739
5-methyl-1-(2-pyrrolidin-1-ylpyridine-3-carbonyl)piperidine-3-carboxylic acid
CID 122117997
phenyl-[4-(2-pyrrolidin-1-ylpyridine-3-carbonyl)piperazin-1-yl]methanone
CID 78806153

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone?
The IUPAC name of (2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone (CID 56813848) is (2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone.
What is the SMILES notation for (2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone?
The canonical SMILES for (2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone is CC1(C)CN(C(=O)c2cccnc2N2CCCCC2)CCO1.
What is the InChIKey of (2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone?
The InChIKey is PHFQLJHKLSOADD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-17(2)13-20(11-12-22-17)16(21)14-7-6-8-18-15(14)19-9-4-3-5-10-19/h6-8H,3-5,9-13H2,1-2H3.
What are the key properties of (2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone?
(2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone has a molecular weight of 303.41 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethylmorpholin-4-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone is sourced from PubChem (CID 56813848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).