2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine

C15H33NO — CID 139652121

IUPAC2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine
SMILESCOCC(CNC(C)C)(CC(C)C)CC(C)C
InChIInChI=1S/C15H33NO/c1-12(2)8-15(11-17-7,9-13(3)4)10-16-14(5)6/h12-14,16H,8-11H2,1-7H3
InChIKeySGYVOVSAYKDKCB-UHFFFAOYSA-N
MW243.43 g/mol
LogP3.71
Rot. Bonds9

About 2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine

2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine (PubChem CID 139652121) has the molecular formula C15H33NO and a molecular weight of 243.43 g/mol. Its IUPAC name is 2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine
PubChem CID139652121
Molecular FormulaC15H33NO
Molecular Weight243.43 g/mol
Exact Mass243.26
IUPAC Name2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine
SMILESCOCC(CNC(C)C)(CC(C)C)CC(C)C
InChIInChI=1S/C15H33NO/c1-12(2)8-15(11-17-7,9-13(3)4)10-16-14(5)6/h12-14,16H,8-11H2,1-7H3
InChIKeySGYVOVSAYKDKCB-UHFFFAOYSA-N
XLogP3.71
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.43
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine?
The IUPAC name of 2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine (CID 139652121) is 2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine.
What is the SMILES notation for 2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine?
The canonical SMILES for 2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine is COCC(CNC(C)C)(CC(C)C)CC(C)C.
What is the InChIKey of 2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine?
The InChIKey is SGYVOVSAYKDKCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO/c1-12(2)8-15(11-17-7,9-13(3)4)10-16-14(5)6/h12-14,16H,8-11H2,1-7H3.
What are the key properties of 2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine?
2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine has a molecular weight of 243.43 g/mol, XLogP of 3.71, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-4-methyl-2-(2-methylpropyl)-N-propan-2-ylpentan-1-amine is sourced from PubChem (CID 139652121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).