N,2,2,5,5-pentamethyloxolan-3-amine

C9H19NO — CID 59679573

IUPACN,2,2,5,5-pentamethyloxolan-3-amine
SMILESCNC1CC(C)(C)OC1(C)C
InChIInChI=1S/C9H19NO/c1-8(2)6-7(10-5)9(3,4)11-8/h7,10H,6H2,1-5H3
InChIKeyXSRWIEDAPNQHHO-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.55
Rot. Bonds1

About N,2,2,5,5-pentamethyloxolan-3-amine

N,2,2,5,5-pentamethyloxolan-3-amine (PubChem CID 59679573) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N,2,2,5,5-pentamethyloxolan-3-amine.

Molecular Properties

Compound NameN,2,2,5,5-pentamethyloxolan-3-amine
PubChem CID59679573
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN,2,2,5,5-pentamethyloxolan-3-amine
SMILESCNC1CC(C)(C)OC1(C)C
InChIInChI=1S/C9H19NO/c1-8(2)6-7(10-5)9(3,4)11-8/h7,10H,6H2,1-5H3
InChIKeyXSRWIEDAPNQHHO-UHFFFAOYSA-N
XLogP1.55
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2,2,5,5-pentamethyloxolan-3-amine?
The IUPAC name of N,2,2,5,5-pentamethyloxolan-3-amine (CID 59679573) is N,2,2,5,5-pentamethyloxolan-3-amine.
What is the SMILES notation for N,2,2,5,5-pentamethyloxolan-3-amine?
The canonical SMILES for N,2,2,5,5-pentamethyloxolan-3-amine is CNC1CC(C)(C)OC1(C)C.
What is the InChIKey of N,2,2,5,5-pentamethyloxolan-3-amine?
The InChIKey is XSRWIEDAPNQHHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8(2)6-7(10-5)9(3,4)11-8/h7,10H,6H2,1-5H3.
What are the key properties of N,2,2,5,5-pentamethyloxolan-3-amine?
N,2,2,5,5-pentamethyloxolan-3-amine has a molecular weight of 157.26 g/mol, XLogP of 1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2,5,5-pentamethyloxolan-3-amine is sourced from PubChem (CID 59679573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).