2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide

C18H29N3O2 — CID 45487780

IUPAC2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide
SMILESCCCC(C)(C)C(=O)Nc1cc(CN2CCOCC2)c(C)cn1
InChIInChI=1S/C18H29N3O2/c1-5-6-18(3,4)17(22)20-16-11-15(14(2)12-19-16)13-21-7-9-23-10-8-21/h11-12H,5-10,13H2,1-4H3,(H,19,20,22)
InChIKeyQZIONUOYWZONRH-UHFFFAOYSA-N
MW319.45 g/mol
LogP2.99
Rot. Bonds6

About 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide

2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide (PubChem CID 45487780) has the molecular formula C18H29N3O2 and a molecular weight of 319.45 g/mol. Its IUPAC name is 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide
PubChem CID45487780
Molecular FormulaC18H29N3O2
Molecular Weight319.45 g/mol
Exact Mass319.23
IUPAC Name2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide
SMILESCCCC(C)(C)C(=O)Nc1cc(CN2CCOCC2)c(C)cn1
InChIInChI=1S/C18H29N3O2/c1-5-6-18(3,4)17(22)20-16-11-15(14(2)12-19-16)13-21-7-9-23-10-8-21/h11-12H,5-10,13H2,1-4H3,(H,19,20,22)
InChIKeyQZIONUOYWZONRH-UHFFFAOYSA-N
XLogP2.99
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.45
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide?
The IUPAC name of 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide (CID 45487780) is 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide.
What is the SMILES notation for 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide?
The canonical SMILES for 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide is CCCC(C)(C)C(=O)Nc1cc(CN2CCOCC2)c(C)cn1.
What is the InChIKey of 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide?
The InChIKey is QZIONUOYWZONRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O2/c1-5-6-18(3,4)17(22)20-16-11-15(14(2)12-19-16)13-21-7-9-23-10-8-21/h11-12H,5-10,13H2,1-4H3,(H,19,20,22).
What are the key properties of 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide?
2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide has a molecular weight of 319.45 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]pentanamide is sourced from PubChem (CID 45487780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).