N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide

C14H21NO — CID 3056052

IUPACN-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide
SMILESO=C(N[C@@H]1C[C@H]2C[C@@H]1[C@@H]1CCC[C@H]21)C1CC1
InChIInChI=1S/C14H21NO/c16-14(8-4-5-8)15-13-7-9-6-12(13)11-3-1-2-10(9)11/h8-13H,1-7H2,(H,15,16)/t9-,10-,11-,12-,13-/m1/s1
InChIKeyRIYPQNZHNVIGPF-SYLRKERUSA-N
MW219.33 g/mol
LogP2.34
Rot. Bonds2

About N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide

N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide (PubChem CID 3056052) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide
PubChem CID3056052
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide
SMILESO=C(N[C@@H]1C[C@H]2C[C@@H]1[C@@H]1CCC[C@H]21)C1CC1
InChIInChI=1S/C14H21NO/c16-14(8-4-5-8)15-13-7-9-6-12(13)11-3-1-2-10(9)11/h8-13H,1-7H2,(H,15,16)/t9-,10-,11-,12-,13-/m1/s1
InChIKeyRIYPQNZHNVIGPF-SYLRKERUSA-N
XLogP2.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide?
The IUPAC name of N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide (CID 3056052) is N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide is O=C(N[C@@H]1C[C@H]2C[C@@H]1[C@@H]1CCC[C@H]21)C1CC1.
What is the InChIKey of N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide?
The InChIKey is RIYPQNZHNVIGPF-SYLRKERUSA-N. The full InChI is InChI=1S/C14H21NO/c16-14(8-4-5-8)15-13-7-9-6-12(13)11-3-1-2-10(9)11/h8-13H,1-7H2,(H,15,16)/t9-,10-,11-,12-,13-/m1/s1.
What are the key properties of N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide?
N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide has a molecular weight of 219.33 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R,6R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopropanecarboxamide is sourced from PubChem (CID 3056052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).