N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide

C15H20N2O2 — CID 83206024

IUPACN-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide
SMILESCN(C(=O)Cn1cc2c(c1)C(=O)CCCC2)C1CC1
InChIInChI=1S/C15H20N2O2/c1-16(12-6-7-12)15(19)10-17-8-11-4-2-3-5-14(18)13(11)9-17/h8-9,12H,2-7,10H2,1H3
InChIKeyJSXQZHPYZYYJOE-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.02
Rot. Bonds3

About N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide

N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide (PubChem CID 83206024) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide
PubChem CID83206024
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide
SMILESCN(C(=O)Cn1cc2c(c1)C(=O)CCCC2)C1CC1
InChIInChI=1S/C15H20N2O2/c1-16(12-6-7-12)15(19)10-17-8-11-4-2-3-5-14(18)13(11)9-17/h8-9,12H,2-7,10H2,1H3
InChIKeyJSXQZHPYZYYJOE-UHFFFAOYSA-N
XLogP2.02
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide?
The IUPAC name of N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide (CID 83206024) is N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide.
What is the SMILES notation for N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide?
The canonical SMILES for N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide is CN(C(=O)Cn1cc2c(c1)C(=O)CCCC2)C1CC1.
What is the InChIKey of N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide?
The InChIKey is JSXQZHPYZYYJOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-16(12-6-7-12)15(19)10-17-8-11-4-2-3-5-14(18)13(11)9-17/h8-9,12H,2-7,10H2,1H3.
What are the key properties of N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide?
N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide has a molecular weight of 260.34 g/mol, XLogP of 2.02, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-methyl-2-(4-oxo-5,6,7,8-tetrahydrocyclohepta[c]pyrrol-2-yl)acetamide is sourced from PubChem (CID 83206024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).