5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide

C19H23ClN2OS — CID 45206214

IUPAC5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide
SMILESO=C(NC1CCCN(CCCc2ccccc2)C1)c1ccc(Cl)s1
InChIInChI=1S/C19H23ClN2OS/c20-18-11-10-17(24-18)19(23)21-16-9-5-13-22(14-16)12-4-8-15-6-2-1-3-7-15/h1-3,6-7,10-11,16H,4-5,8-9,12-14H2,(H,21,23)
InChIKeyHYDUXWBKHPYSSB-UHFFFAOYSA-N
MW362.93 g/mol
LogP4.23
Rot. Bonds6

About 5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide

5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide (PubChem CID 45206214) has the molecular formula C19H23ClN2OS and a molecular weight of 362.93 g/mol. Its IUPAC name is 5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide
PubChem CID45206214
Molecular FormulaC19H23ClN2OS
Molecular Weight362.93 g/mol
Exact Mass362.12
IUPAC Name5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide
SMILESO=C(NC1CCCN(CCCc2ccccc2)C1)c1ccc(Cl)s1
InChIInChI=1S/C19H23ClN2OS/c20-18-11-10-17(24-18)19(23)21-16-9-5-13-22(14-16)12-4-8-15-6-2-1-3-7-15/h1-3,6-7,10-11,16H,4-5,8-9,12-14H2,(H,21,23)
InChIKeyHYDUXWBKHPYSSB-UHFFFAOYSA-N
XLogP4.23
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.93
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-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 5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide (CID 45206214) is 5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide is O=C(NC1CCCN(CCCc2ccccc2)C1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide?
The InChIKey is HYDUXWBKHPYSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2OS/c20-18-11-10-17(24-18)19(23)21-16-9-5-13-22(14-16)12-4-8-15-6-2-1-3-7-15/h1-3,6-7,10-11,16H,4-5,8-9,12-14H2,(H,21,23).
What are the key properties of 5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide?
5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide has a molecular weight of 362.93 g/mol, XLogP of 4.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[1-(3-phenylpropyl)piperidin-3-yl]thiophene-2-carboxamide is sourced from PubChem (CID 45206214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).