2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide

C18H24N2O2 — CID 118739004

IUPAC2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide
SMILESO=C(CC1CC1)NC1CCc2c(ccc(=O)n2CC2CC2)C1
InChIInChI=1S/C18H24N2O2/c21-17(9-12-1-2-12)19-15-6-7-16-14(10-15)5-8-18(22)20(16)11-13-3-4-13/h5,8,12-13,15H,1-4,6-7,9-11H2,(H,19,21)
InChIKeySDVIAWVVWOJKNP-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.03
Rot. Bonds5

About 2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide

2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide (PubChem CID 118739004) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide
PubChem CID118739004
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide
SMILESO=C(CC1CC1)NC1CCc2c(ccc(=O)n2CC2CC2)C1
InChIInChI=1S/C18H24N2O2/c21-17(9-12-1-2-12)19-15-6-7-16-14(10-15)5-8-18(22)20(16)11-13-3-4-13/h5,8,12-13,15H,1-4,6-7,9-11H2,(H,19,21)
InChIKeySDVIAWVVWOJKNP-UHFFFAOYSA-N
XLogP2.03
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide?
The IUPAC name of 2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide (CID 118739004) is 2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide.
What is the SMILES notation for 2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide?
The canonical SMILES for 2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide is O=C(CC1CC1)NC1CCc2c(ccc(=O)n2CC2CC2)C1.
What is the InChIKey of 2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide?
The InChIKey is SDVIAWVVWOJKNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c21-17(9-12-1-2-12)19-15-6-7-16-14(10-15)5-8-18(22)20(16)11-13-3-4-13/h5,8,12-13,15H,1-4,6-7,9-11H2,(H,19,21).
What are the key properties of 2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide?
2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide has a molecular weight of 300.40 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]acetamide is sourced from PubChem (CID 118739004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).