10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide

C18H32N4O — CID 168983821

IUPAC10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide
SMILESCN1CCN(CC2CC2)C2(CCN(C(=O)N(C)C)C3(CC3)C2)C1
InChIInChI=1S/C18H32N4O/c1-19(2)16(23)22-9-8-18(13-17(22)6-7-17)14-20(3)10-11-21(18)12-15-4-5-15/h15H,4-14H2,1-3H3
InChIKeyLYAJJDWBFGRDJV-UHFFFAOYSA-N
MW320.48 g/mol
LogP1.69
Rot. Bonds2

About 10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide

10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide (PubChem CID 168983821) has the molecular formula C18H32N4O and a molecular weight of 320.48 g/mol. Its IUPAC name is 10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide.

Molecular Properties

Compound Name10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide
PubChem CID168983821
Molecular FormulaC18H32N4O
Molecular Weight320.48 g/mol
Exact Mass320.26
IUPAC Name10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide
SMILESCN1CCN(CC2CC2)C2(CCN(C(=O)N(C)C)C3(CC3)C2)C1
InChIInChI=1S/C18H32N4O/c1-19(2)16(23)22-9-8-18(13-17(22)6-7-17)14-20(3)10-11-21(18)12-15-4-5-15/h15H,4-14H2,1-3H3
InChIKeyLYAJJDWBFGRDJV-UHFFFAOYSA-N
XLogP1.69
TPSA30.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.48
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide?
The IUPAC name of 10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide (CID 168983821) is 10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide.
What is the SMILES notation for 10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide?
The canonical SMILES for 10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide is CN1CCN(CC2CC2)C2(CCN(C(=O)N(C)C)C3(CC3)C2)C1.
What is the InChIKey of 10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide?
The InChIKey is LYAJJDWBFGRDJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O/c1-19(2)16(23)22-9-8-18(13-17(22)6-7-17)14-20(3)10-11-21(18)12-15-4-5-15/h15H,4-14H2,1-3H3.
What are the key properties of 10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide?
10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide has a molecular weight of 320.48 g/mol, XLogP of 1.69, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(cyclopropylmethyl)-N,N,7-trimethyl-7,10,13-triazadispiro[2.1.55.33]tridecane-13-carboxamide is sourced from PubChem (CID 168983821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).