1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine

C14H24N2O — CID 62296147

IUPAC1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine
SMILESCCCCCOc1nc(C)cc(C)c1CNC
InChIInChI=1S/C14H24N2O/c1-5-6-7-8-17-14-13(10-15-4)11(2)9-12(3)16-14/h9,15H,5-8,10H2,1-4H3
InChIKeyNAKNQULKEPHORP-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.99
Rot. Bonds7

About 1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine

1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine (PubChem CID 62296147) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine
PubChem CID62296147
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine
SMILESCCCCCOc1nc(C)cc(C)c1CNC
InChIInChI=1S/C14H24N2O/c1-5-6-7-8-17-14-13(10-15-4)11(2)9-12(3)16-14/h9,15H,5-8,10H2,1-4H3
InChIKeyNAKNQULKEPHORP-UHFFFAOYSA-N
XLogP2.99
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-pentoxy-3-pyridinyl)-N-methylmethanamine?
The IUPAC name of 1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine (CID 62296147) is 1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine.
What is the SMILES notation for 1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine?
The canonical SMILES for 1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine is CCCCCOc1nc(C)cc(C)c1CNC.
What is the InChIKey of 1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine?
The InChIKey is NAKNQULKEPHORP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-5-6-7-8-17-14-13(10-15-4)11(2)9-12(3)16-14/h9,15H,5-8,10H2,1-4H3.
What are the key properties of 1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine?
1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine has a molecular weight of 236.36 g/mol, XLogP of 2.99, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethyl-2-pentoxy-3-pyridinyl)-N-methylmethanamine is sourced from PubChem (CID 62296147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).