N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide

C20H23N3O2 — CID 15293518

IUPACN-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide
SMILESO=C(NC1C2CC3CC1CN(C3)C2)N1C(=O)C2(CC2)c2ccccc21
InChIInChI=1S/C20H23N3O2/c24-18-20(5-6-20)15-3-1-2-4-16(15)23(18)19(25)21-17-13-7-12-8-14(17)11-22(9-12)10-13/h1-4,12-14,17H,5-11H2,(H,21,25)
InChIKeyBTVBDFDAXXNVKW-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.11
Rot. Bonds1

About N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide

N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide (PubChem CID 15293518) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide.

Molecular Properties

Compound NameN-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide
PubChem CID15293518
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide
SMILESO=C(NC1C2CC3CC1CN(C3)C2)N1C(=O)C2(CC2)c2ccccc21
InChIInChI=1S/C20H23N3O2/c24-18-20(5-6-20)15-3-1-2-4-16(15)23(18)19(25)21-17-13-7-12-8-14(17)11-22(9-12)10-13/h1-4,12-14,17H,5-11H2,(H,21,25)
InChIKeyBTVBDFDAXXNVKW-UHFFFAOYSA-N
XLogP2.11
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide?
The IUPAC name of N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide (CID 15293518) is N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide.
What is the SMILES notation for N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide?
The canonical SMILES for N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide is O=C(NC1C2CC3CC1CN(C3)C2)N1C(=O)C2(CC2)c2ccccc21.
What is the InChIKey of N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide?
The InChIKey is BTVBDFDAXXNVKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c24-18-20(5-6-20)15-3-1-2-4-16(15)23(18)19(25)21-17-13-7-12-8-14(17)11-22(9-12)10-13/h1-4,12-14,17H,5-11H2,(H,21,25).
What are the key properties of N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide?
N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 2.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-azatricyclo[3.3.1.13,7]decan-4-yl)-2'-oxospiro[cyclopropane-1,3'-indole]-1'-carboxamide is sourced from PubChem (CID 15293518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).