2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide

C16H28N2O2 — CID 162657160

IUPAC2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide
SMILESCC1(C)[C@@H]2CC[C@@]1(C)[C@H](NC(=O)CN1CCOCC1)C2
InChIInChI=1S/C16H28N2O2/c1-15(2)12-4-5-16(15,3)13(10-12)17-14(19)11-18-6-8-20-9-7-18/h12-13H,4-11H2,1-3H3,(H,17,19)/t12-,13-,16+/m1/s1
InChIKeyPOTHHIDCXDXNSM-IOASZLSFSA-N
MW280.41 g/mol
LogP1.65
Rot. Bonds3

About 2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide

2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide (PubChem CID 162657160) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide.

Molecular Properties

Compound Name2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide
PubChem CID162657160
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide
SMILESCC1(C)[C@@H]2CC[C@@]1(C)[C@H](NC(=O)CN1CCOCC1)C2
InChIInChI=1S/C16H28N2O2/c1-15(2)12-4-5-16(15,3)13(10-12)17-14(19)11-18-6-8-20-9-7-18/h12-13H,4-11H2,1-3H3,(H,17,19)/t12-,13-,16+/m1/s1
InChIKeyPOTHHIDCXDXNSM-IOASZLSFSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide?
The IUPAC name of 2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide (CID 162657160) is 2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide.
What is the SMILES notation for 2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide?
The canonical SMILES for 2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide is CC1(C)[C@@H]2CC[C@@]1(C)[C@H](NC(=O)CN1CCOCC1)C2.
What is the InChIKey of 2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide?
The InChIKey is POTHHIDCXDXNSM-IOASZLSFSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-15(2)12-4-5-16(15,3)13(10-12)17-14(19)11-18-6-8-20-9-7-18/h12-13H,4-11H2,1-3H3,(H,17,19)/t12-,13-,16+/m1/s1.
What are the key properties of 2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide?
2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide has a molecular weight of 280.41 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]acetamide is sourced from PubChem (CID 162657160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).