(2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone

C19H29N3O2 — CID 84592971

IUPAC(2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone
SMILESCc1ncccc1CN1CCC(C(=O)N2CC(C)OC(C)C2)CC1
InChIInChI=1S/C19H29N3O2/c1-14-11-22(12-15(2)24-14)19(23)17-6-9-21(10-7-17)13-18-5-4-8-20-16(18)3/h4-5,8,14-15,17H,6-7,9-13H2,1-3H3
InChIKeyVDHRHOKJLANSSK-UHFFFAOYSA-N
MW331.46 g/mol
LogP2.24
Rot. Bonds3

About (2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone

(2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone (PubChem CID 84592971) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone
PubChem CID84592971
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC Name(2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone
SMILESCc1ncccc1CN1CCC(C(=O)N2CC(C)OC(C)C2)CC1
InChIInChI=1S/C19H29N3O2/c1-14-11-22(12-15(2)24-14)19(23)17-6-9-21(10-7-17)13-18-5-4-8-20-16(18)3/h4-5,8,14-15,17H,6-7,9-13H2,1-3H3
InChIKeyVDHRHOKJLANSSK-UHFFFAOYSA-N
XLogP2.24
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone (CID 84592971) is (2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone is Cc1ncccc1CN1CCC(C(=O)N2CC(C)OC(C)C2)CC1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone?
The InChIKey is VDHRHOKJLANSSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2/c1-14-11-22(12-15(2)24-14)19(23)17-6-9-21(10-7-17)13-18-5-4-8-20-16(18)3/h4-5,8,14-15,17H,6-7,9-13H2,1-3H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone?
(2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone has a molecular weight of 331.46 g/mol, XLogP of 2.24, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-[1-[(2-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanone is sourced from PubChem (CID 84592971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).