2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine

C10H21NO2 — CID 43368319

IUPAC2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine
SMILESCC(CN)COCC1CCCCO1
InChIInChI=1S/C10H21NO2/c1-9(6-11)7-12-8-10-4-2-3-5-13-10/h9-10H,2-8,11H2,1H3
InChIKeySUSKEQHFLPIYAG-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.17
Rot. Bonds5

About 2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine

2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine (PubChem CID 43368319) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine.

Molecular Properties

Compound Name2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine
PubChem CID43368319
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine
SMILESCC(CN)COCC1CCCCO1
InChIInChI=1S/C10H21NO2/c1-9(6-11)7-12-8-10-4-2-3-5-13-10/h9-10H,2-8,11H2,1H3
InChIKeySUSKEQHFLPIYAG-UHFFFAOYSA-N
XLogP1.17
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine?
The IUPAC name of 2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine (CID 43368319) is 2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine.
What is the SMILES notation for 2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine?
The canonical SMILES for 2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine is CC(CN)COCC1CCCCO1.
What is the InChIKey of 2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine?
The InChIKey is SUSKEQHFLPIYAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-9(6-11)7-12-8-10-4-2-3-5-13-10/h9-10H,2-8,11H2,1H3.
What are the key properties of 2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine?
2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine has a molecular weight of 187.28 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(oxan-2-ylmethoxy)propan-1-amine is sourced from PubChem (CID 43368319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).