1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine

C14H24N2O2 — CID 62291972

IUPAC1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1c(C)cc(C)nc1OCCOC(C)C
InChIInChI=1S/C14H24N2O2/c1-10(2)17-6-7-18-14-13(9-15-5)11(3)8-12(4)16-14/h8,10,15H,6-7,9H2,1-5H3
InChIKeyNUQKKPCBBCYTOV-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.22
Rot. Bonds7

About 1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine

1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine (PubChem CID 62291972) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine
PubChem CID62291972
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1c(C)cc(C)nc1OCCOC(C)C
InChIInChI=1S/C14H24N2O2/c1-10(2)17-6-7-18-14-13(9-15-5)11(3)8-12(4)16-14/h8,10,15H,6-7,9H2,1-5H3
InChIKeyNUQKKPCBBCYTOV-UHFFFAOYSA-N
XLogP2.22
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine (CID 62291972) is 1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine is CNCc1c(C)cc(C)nc1OCCOC(C)C.
What is the InChIKey of 1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine?
The InChIKey is NUQKKPCBBCYTOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-10(2)17-6-7-18-14-13(9-15-5)11(3)8-12(4)16-14/h8,10,15H,6-7,9H2,1-5H3.
What are the key properties of 1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine?
1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine has a molecular weight of 252.36 g/mol, XLogP of 2.22, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4,6-dimethyl-2-(2-propan-2-yloxyethoxy)-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 62291972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).