7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine

C15H28N2O — CID 58498634

IUPAC7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine
SMILESCC1(C)C2CCC1(CCN1CCOCC1)C(N)C2
InChIInChI=1S/C15H28N2O/c1-14(2)12-3-4-15(14,13(16)11-12)5-6-17-7-9-18-10-8-17/h12-13H,3-11,16H2,1-2H3
InChIKeyZTZUWAMPMRZXBP-UHFFFAOYSA-N
MW252.40 g/mol
LogP1.86
Rot. Bonds3

About 7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine

7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine (PubChem CID 58498634) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound Name7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine
PubChem CID58498634
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine
SMILESCC1(C)C2CCC1(CCN1CCOCC1)C(N)C2
InChIInChI=1S/C15H28N2O/c1-14(2)12-3-4-15(14,13(16)11-12)5-6-17-7-9-18-10-8-17/h12-13H,3-11,16H2,1-2H3
InChIKeyZTZUWAMPMRZXBP-UHFFFAOYSA-N
XLogP1.86
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine?
The IUPAC name of 7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine (CID 58498634) is 7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for 7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for 7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine is CC1(C)C2CCC1(CCN1CCOCC1)C(N)C2.
What is the InChIKey of 7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine?
The InChIKey is ZTZUWAMPMRZXBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-14(2)12-3-4-15(14,13(16)11-12)5-6-17-7-9-18-10-8-17/h12-13H,3-11,16H2,1-2H3.
What are the key properties of 7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine?
7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine has a molecular weight of 252.40 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-1-(2-morpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 58498634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).