N-methyl-N-(oxan-2-ylmethyl)ethanamine

C9H19NO — CID 143886318

IUPACN-methyl-N-(oxan-2-ylmethyl)ethanamine
SMILESCCN(C)CC1CCCCO1
InChIInChI=1S/C9H19NO/c1-3-10(2)8-9-6-4-5-7-11-9/h9H,3-8H2,1-2H3
InChIKeyPGJMMZKLKWZECU-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.51
Rot. Bonds3

About N-methyl-N-(oxan-2-ylmethyl)ethanamine

N-methyl-N-(oxan-2-ylmethyl)ethanamine (PubChem CID 143886318) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N-methyl-N-(oxan-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-methyl-N-(oxan-2-ylmethyl)ethanamine
PubChem CID143886318
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN-methyl-N-(oxan-2-ylmethyl)ethanamine
SMILESCCN(C)CC1CCCCO1
InChIInChI=1S/C9H19NO/c1-3-10(2)8-9-6-4-5-7-11-9/h9H,3-8H2,1-2H3
InChIKeyPGJMMZKLKWZECU-UHFFFAOYSA-N
XLogP1.51
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxan-2-ylmethyl)ethanamine?
The IUPAC name of N-methyl-N-(oxan-2-ylmethyl)ethanamine (CID 143886318) is N-methyl-N-(oxan-2-ylmethyl)ethanamine.
What is the SMILES notation for N-methyl-N-(oxan-2-ylmethyl)ethanamine?
The canonical SMILES for N-methyl-N-(oxan-2-ylmethyl)ethanamine is CCN(C)CC1CCCCO1.
What is the InChIKey of N-methyl-N-(oxan-2-ylmethyl)ethanamine?
The InChIKey is PGJMMZKLKWZECU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-3-10(2)8-9-6-4-5-7-11-9/h9H,3-8H2,1-2H3.
What are the key properties of N-methyl-N-(oxan-2-ylmethyl)ethanamine?
N-methyl-N-(oxan-2-ylmethyl)ethanamine has a molecular weight of 157.26 g/mol, XLogP of 1.51, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxan-2-ylmethyl)ethanamine is sourced from PubChem (CID 143886318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).