4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine

C12H24N2O — CID 167251730

IUPAC4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine
SMILESCC1CN(C(C)C)CC1N1CCOCC1
InChIInChI=1S/C12H24N2O/c1-10(2)14-8-11(3)12(9-14)13-4-6-15-7-5-13/h10-12H,4-9H2,1-3H3
InChIKeyHUFFPQLGDNKFSA-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.05
Rot. Bonds2

About 4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine

4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine (PubChem CID 167251730) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine.

Molecular Properties

Compound Name4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine
PubChem CID167251730
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine
SMILESCC1CN(C(C)C)CC1N1CCOCC1
InChIInChI=1S/C12H24N2O/c1-10(2)14-8-11(3)12(9-14)13-4-6-15-7-5-13/h10-12H,4-9H2,1-3H3
InChIKeyHUFFPQLGDNKFSA-UHFFFAOYSA-N
XLogP1.05
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine?
The IUPAC name of 4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine (CID 167251730) is 4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine.
What is the SMILES notation for 4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine?
The canonical SMILES for 4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine is CC1CN(C(C)C)CC1N1CCOCC1.
What is the InChIKey of 4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine?
The InChIKey is HUFFPQLGDNKFSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10(2)14-8-11(3)12(9-14)13-4-6-15-7-5-13/h10-12H,4-9H2,1-3H3.
What are the key properties of 4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine?
4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine has a molecular weight of 212.34 g/mol, XLogP of 1.05, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)morpholine is sourced from PubChem (CID 167251730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).