2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride

C17H24Cl2N6O — CID 119825218

IUPAC2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride
SMILESCCCN(C(=O)Cn1nnc(-c2ccc(Cl)cc2)n1)C1CCNCC1.Cl
InChIInChI=1S/C17H23ClN6O.ClH/c1-2-11-23(15-7-9-19-10-8-15)16(25)12-24-21-17(20-22-24)13-3-5-14(18)6-4-13;/h3-6,15,19H,2,7-12H2,1H3;1H
InChIKeyUIXGHBKHKDOCRJ-UHFFFAOYSA-N
MW399.33 g/mol
LogP2.41
Rot. Bonds6

About 2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride

2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride (PubChem CID 119825218) has the molecular formula C17H24Cl2N6O and a molecular weight of 399.33 g/mol. Its IUPAC name is 2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride.

Molecular Properties

Compound Name2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride
PubChem CID119825218
Molecular FormulaC17H24Cl2N6O
Molecular Weight399.33 g/mol
Exact Mass398.14
IUPAC Name2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride
SMILESCCCN(C(=O)Cn1nnc(-c2ccc(Cl)cc2)n1)C1CCNCC1.Cl
InChIInChI=1S/C17H23ClN6O.ClH/c1-2-11-23(15-7-9-19-10-8-15)16(25)12-24-21-17(20-22-24)13-3-5-14(18)6-4-13;/h3-6,15,19H,2,7-12H2,1H3;1H
InChIKeyUIXGHBKHKDOCRJ-UHFFFAOYSA-N
XLogP2.41
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.33
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride with MolForge

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

Launch Full Analysis

Related Compounds

2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-[(3R)-1,1-dioxothiolan-3-yl]-N-ethylacetamide
CID 2569152
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-cyclopentyl-N-[2-(cyclopentylamino)-2-oxoethyl]acetamide
CID 3179691
3-(4-chlorophenyl)sulfanyl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119824335
2-(5-phenyltetrazol-2-yl)-N-piperidin-4-yl-N-propylpropanamide
CID 119826421
1-(4-chlorophenyl)-N-piperidin-4-yl-N-propylpyrazole-4-carboxamide
CID 119825391
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-(2-pyrrolidin-3-ylethyl)acetamide;hydrochloride
CID 119536552
N-(1-aminopropan-2-yl)-2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-methylacetamide
CID 119583894
4-chloro-N-ethyl-N-piperidin-4-ylbenzamide
CID 54923441
2-(4-chloro-N-[2-[5-(4-fluorophenyl)tetrazol-2-yl]acetyl]anilino)-N-cyclopentylpentanamide
CID 3180024
2-(4-chlorophenoxy)-N-propyl-N-pyrrolidin-3-ylacetamide
CID 63301188
3-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]-N-propyl-N-pyrrolidin-3-ylpropanamide;dihydrochloride
CID 126773837
2-[(4-chlorophenyl)methylcarbamoylamino]-N-piperidin-4-yl-N-propylacetamide
CID 119824208

Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
The IUPAC name of 2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride (CID 119825218) is 2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride.
What is the SMILES notation for 2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
The canonical SMILES for 2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride is CCCN(C(=O)Cn1nnc(-c2ccc(Cl)cc2)n1)C1CCNCC1.Cl.
What is the InChIKey of 2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
The InChIKey is UIXGHBKHKDOCRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23ClN6O.ClH/c1-2-11-23(15-7-9-19-10-8-15)16(25)12-24-21-17(20-22-24)13-3-5-14(18)6-4-13;/h3-6,15,19H,2,7-12H2,1H3;1H.
What are the key properties of 2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride has a molecular weight of 399.33 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-piperidin-4-yl-N-propylacetamide;hydrochloride is sourced from PubChem (CID 119825218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).