2-methyl-N,N-di(propan-2-yl)oxolan-3-amine

C11H23NO — CID 22975538

IUPAC2-methyl-N,N-di(propan-2-yl)oxolan-3-amine
SMILESCC1OCCC1N(C(C)C)C(C)C
InChIInChI=1S/C11H23NO/c1-8(2)12(9(3)4)11-6-7-13-10(11)5/h8-11H,6-7H2,1-5H3
InChIKeyQOWRJABXFHANMX-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.28
Rot. Bonds3

About 2-methyl-N,N-di(propan-2-yl)oxolan-3-amine

2-methyl-N,N-di(propan-2-yl)oxolan-3-amine (PubChem CID 22975538) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2-methyl-N,N-di(propan-2-yl)oxolan-3-amine.

Molecular Properties

Compound Name2-methyl-N,N-di(propan-2-yl)oxolan-3-amine
PubChem CID22975538
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2-methyl-N,N-di(propan-2-yl)oxolan-3-amine
SMILESCC1OCCC1N(C(C)C)C(C)C
InChIInChI=1S/C11H23NO/c1-8(2)12(9(3)4)11-6-7-13-10(11)5/h8-11H,6-7H2,1-5H3
InChIKeyQOWRJABXFHANMX-UHFFFAOYSA-N
XLogP2.28
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N,N-di(propan-2-yl)oxolan-3-amine?
The IUPAC name of 2-methyl-N,N-di(propan-2-yl)oxolan-3-amine (CID 22975538) is 2-methyl-N,N-di(propan-2-yl)oxolan-3-amine.
What is the SMILES notation for 2-methyl-N,N-di(propan-2-yl)oxolan-3-amine?
The canonical SMILES for 2-methyl-N,N-di(propan-2-yl)oxolan-3-amine is CC1OCCC1N(C(C)C)C(C)C.
What is the InChIKey of 2-methyl-N,N-di(propan-2-yl)oxolan-3-amine?
The InChIKey is QOWRJABXFHANMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-8(2)12(9(3)4)11-6-7-13-10(11)5/h8-11H,6-7H2,1-5H3.
What are the key properties of 2-methyl-N,N-di(propan-2-yl)oxolan-3-amine?
2-methyl-N,N-di(propan-2-yl)oxolan-3-amine has a molecular weight of 185.31 g/mol, XLogP of 2.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N,N-di(propan-2-yl)oxolan-3-amine is sourced from PubChem (CID 22975538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).