N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide

C12H19NO — CID 11862021

IUPACN-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide
SMILESCC(=O)N[C@H]1C[C@H]2C[C@@H]3C[C@H](C2)[C@H]1C3
InChIInChI=1S/C12H19NO/c1-7(14)13-12-6-9-2-8-3-10(4-9)11(12)5-8/h8-12H,2-6H2,1H3,(H,13,14)/t8-,9+,10-,11-,12+/m1/s1
InChIKeyLRIGKFYDQZCIJH-ROHXPCBUSA-N
MW193.29 g/mol
LogP1.95
Rot. Bonds1

About N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide

N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide (PubChem CID 11862021) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide.

Molecular Properties

Compound NameN-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide
PubChem CID11862021
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC NameN-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide
SMILESCC(=O)N[C@H]1C[C@H]2C[C@@H]3C[C@H](C2)[C@H]1C3
InChIInChI=1S/C12H19NO/c1-7(14)13-12-6-9-2-8-3-10(4-9)11(12)5-8/h8-12H,2-6H2,1H3,(H,13,14)/t8-,9+,10-,11-,12+/m1/s1
InChIKeyLRIGKFYDQZCIJH-ROHXPCBUSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide?
The IUPAC name of N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide (CID 11862021) is N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide.
What is the SMILES notation for N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide?
The canonical SMILES for N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide is CC(=O)N[C@H]1C[C@H]2C[C@@H]3C[C@H](C2)[C@H]1C3.
What is the InChIKey of N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide?
The InChIKey is LRIGKFYDQZCIJH-ROHXPCBUSA-N. The full InChI is InChI=1S/C12H19NO/c1-7(14)13-12-6-9-2-8-3-10(4-9)11(12)5-8/h8-12H,2-6H2,1H3,(H,13,14)/t8-,9+,10-,11-,12+/m1/s1.
What are the key properties of N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide?
N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide has a molecular weight of 193.29 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,3R,4S,6S,8R)-4-tricyclo[4.3.1.03,8]decanyl]acetamide is sourced from PubChem (CID 11862021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).