2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide

C16H22N2O — CID 62306443

IUPAC2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
SMILESO=C(CC1CCCN1)NC1CCc2ccccc2C1
InChIInChI=1S/C16H22N2O/c19-16(11-14-6-3-9-17-14)18-15-8-7-12-4-1-2-5-13(12)10-15/h1-2,4-5,14-15,17H,3,6-11H2,(H,18,19)
InChIKeySSVSJZOELTVBJU-UHFFFAOYSA-N
MW258.36 g/mol
LogP1.80
Rot. Bonds3

About 2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide

2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide (PubChem CID 62306443) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide.

Molecular Properties

Compound Name2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
PubChem CID62306443
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
SMILESO=C(CC1CCCN1)NC1CCc2ccccc2C1
InChIInChI=1S/C16H22N2O/c19-16(11-14-6-3-9-17-14)18-15-8-7-12-4-1-2-5-13(12)10-15/h1-2,4-5,14-15,17H,3,6-11H2,(H,18,19)
InChIKeySSVSJZOELTVBJU-UHFFFAOYSA-N
XLogP1.80
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
The IUPAC name of 2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide (CID 62306443) is 2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide.
What is the SMILES notation for 2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
The canonical SMILES for 2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide is O=C(CC1CCCN1)NC1CCc2ccccc2C1.
What is the InChIKey of 2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
The InChIKey is SSVSJZOELTVBJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c19-16(11-14-6-3-9-17-14)18-15-8-7-12-4-1-2-5-13(12)10-15/h1-2,4-5,14-15,17H,3,6-11H2,(H,18,19).
What are the key properties of 2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide has a molecular weight of 258.36 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide is sourced from PubChem (CID 62306443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).