4-[1-(2-methylpropyl)cyclopropyl]morpholine

C11H21NO — CID 170001181

IUPAC4-[1-(2-methylpropyl)cyclopropyl]morpholine
SMILESCC(C)CC1(N2CCOCC2)CC1
InChIInChI=1S/C11H21NO/c1-10(2)9-11(3-4-11)12-5-7-13-8-6-12/h10H,3-9H2,1-2H3
InChIKeySEDMMYYNQHTYPK-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.90
Rot. Bonds3

About 4-[1-(2-methylpropyl)cyclopropyl]morpholine

4-[1-(2-methylpropyl)cyclopropyl]morpholine (PubChem CID 170001181) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-[1-(2-methylpropyl)cyclopropyl]morpholine.

Molecular Properties

Compound Name4-[1-(2-methylpropyl)cyclopropyl]morpholine
PubChem CID170001181
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-[1-(2-methylpropyl)cyclopropyl]morpholine
SMILESCC(C)CC1(N2CCOCC2)CC1
InChIInChI=1S/C11H21NO/c1-10(2)9-11(3-4-11)12-5-7-13-8-6-12/h10H,3-9H2,1-2H3
InChIKeySEDMMYYNQHTYPK-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(2-methylpropyl)cyclopropyl]morpholine?
The IUPAC name of 4-[1-(2-methylpropyl)cyclopropyl]morpholine (CID 170001181) is 4-[1-(2-methylpropyl)cyclopropyl]morpholine.
What is the SMILES notation for 4-[1-(2-methylpropyl)cyclopropyl]morpholine?
The canonical SMILES for 4-[1-(2-methylpropyl)cyclopropyl]morpholine is CC(C)CC1(N2CCOCC2)CC1.
What is the InChIKey of 4-[1-(2-methylpropyl)cyclopropyl]morpholine?
The InChIKey is SEDMMYYNQHTYPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(2)9-11(3-4-11)12-5-7-13-8-6-12/h10H,3-9H2,1-2H3.
What are the key properties of 4-[1-(2-methylpropyl)cyclopropyl]morpholine?
4-[1-(2-methylpropyl)cyclopropyl]morpholine has a molecular weight of 183.29 g/mol, XLogP of 1.90, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2-methylpropyl)cyclopropyl]morpholine is sourced from PubChem (CID 170001181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).