N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide

C15H22N2O2 — CID 131925768

IUPACN-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide
SMILESCc1cc(C)nc(CN(C)C(=O)CC2CCOC2)c1
InChIInChI=1S/C15H22N2O2/c1-11-6-12(2)16-14(7-11)9-17(3)15(18)8-13-4-5-19-10-13/h6-7,13H,4-5,8-10H2,1-3H3
InChIKeyBICQKUTUONEZSS-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.08
Rot. Bonds4

About N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide

N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide (PubChem CID 131925768) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide.

Molecular Properties

Compound NameN-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide
PubChem CID131925768
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide
SMILESCc1cc(C)nc(CN(C)C(=O)CC2CCOC2)c1
InChIInChI=1S/C15H22N2O2/c1-11-6-12(2)16-14(7-11)9-17(3)15(18)8-13-4-5-19-10-13/h6-7,13H,4-5,8-10H2,1-3H3
InChIKeyBICQKUTUONEZSS-UHFFFAOYSA-N
XLogP2.08
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide?
The IUPAC name of N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide (CID 131925768) is N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide.
What is the SMILES notation for N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide?
The canonical SMILES for N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide is Cc1cc(C)nc(CN(C)C(=O)CC2CCOC2)c1.
What is the InChIKey of N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide?
The InChIKey is BICQKUTUONEZSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-6-12(2)16-14(7-11)9-17(3)15(18)8-13-4-5-19-10-13/h6-7,13H,4-5,8-10H2,1-3H3.
What are the key properties of N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide?
N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 2.08, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(oxolan-3-yl)acetamide is sourced from PubChem (CID 131925768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).