N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide

C20H19NOS — CID 71781403

IUPACN-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide
SMILESO=C(c1cccc2ccccc12)N(CCc1cccs1)C1CC1
InChIInChI=1S/C20H19NOS/c22-20(19-9-3-6-15-5-1-2-8-18(15)19)21(16-10-11-16)13-12-17-7-4-14-23-17/h1-9,14,16H,10-13H2
InChIKeyABFNEULHDOYJQJ-UHFFFAOYSA-N
MW321.44 g/mol
LogP4.75
Rot. Bonds5

About N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide

N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide (PubChem CID 71781403) has the molecular formula C20H19NOS and a molecular weight of 321.44 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide
PubChem CID71781403
Molecular FormulaC20H19NOS
Molecular Weight321.44 g/mol
Exact Mass321.12
IUPAC NameN-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide
SMILESO=C(c1cccc2ccccc12)N(CCc1cccs1)C1CC1
InChIInChI=1S/C20H19NOS/c22-20(19-9-3-6-15-5-1-2-8-18(15)19)21(16-10-11-16)13-12-17-7-4-14-23-17/h1-9,14,16H,10-13H2
InChIKeyABFNEULHDOYJQJ-UHFFFAOYSA-N
XLogP4.75
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.44
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide?
The IUPAC name of N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide (CID 71781403) is N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide?
The canonical SMILES for N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide is O=C(c1cccc2ccccc12)N(CCc1cccs1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide?
The InChIKey is ABFNEULHDOYJQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NOS/c22-20(19-9-3-6-15-5-1-2-8-18(15)19)21(16-10-11-16)13-12-17-7-4-14-23-17/h1-9,14,16H,10-13H2.
What are the key properties of N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide?
N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide has a molecular weight of 321.44 g/mol, XLogP of 4.75, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-thiophen-2-ylethyl)naphthalene-1-carboxamide is sourced from PubChem (CID 71781403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).