8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide

C15H20N2O — CID 118008523

IUPAC8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide
SMILESNC(=O)c1cccc2c1C(C1CCCN1)CCC2
InChIInChI=1S/C15H20N2O/c16-15(18)12-7-2-5-10-4-1-6-11(14(10)12)13-8-3-9-17-13/h2,5,7,11,13,17H,1,3-4,6,8-9H2,(H2,16,18)
InChIKeyUFZKYEPPRHJJCC-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.96
Rot. Bonds2

About 8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide

8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide (PubChem CID 118008523) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide.

Molecular Properties

Compound Name8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide
PubChem CID118008523
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide
SMILESNC(=O)c1cccc2c1C(C1CCCN1)CCC2
InChIInChI=1S/C15H20N2O/c16-15(18)12-7-2-5-10-4-1-6-11(14(10)12)13-8-3-9-17-13/h2,5,7,11,13,17H,1,3-4,6,8-9H2,(H2,16,18)
InChIKeyUFZKYEPPRHJJCC-UHFFFAOYSA-N
XLogP1.96
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide?
The IUPAC name of 8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide (CID 118008523) is 8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide.
What is the SMILES notation for 8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide?
The canonical SMILES for 8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide is NC(=O)c1cccc2c1C(C1CCCN1)CCC2.
What is the InChIKey of 8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide?
The InChIKey is UFZKYEPPRHJJCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c16-15(18)12-7-2-5-10-4-1-6-11(14(10)12)13-8-3-9-17-13/h2,5,7,11,13,17H,1,3-4,6,8-9H2,(H2,16,18).
What are the key properties of 8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide?
8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide has a molecular weight of 244.34 g/mol, XLogP of 1.96, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide is sourced from PubChem (CID 118008523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).