N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride

C19H30Cl2N2O — CID 73348065

IUPACN-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride
SMILESCl.O=C(CCCN1CCCCC1)NCCCCc1ccc(Cl)cc1
InChIInChI=1S/C19H29ClN2O.ClH/c20-18-11-9-17(10-12-18)7-2-3-13-21-19(23)8-6-16-22-14-4-1-5-15-22;/h9-12H,1-8,13-16H2,(H,21,23);1H
InChIKeyRMLMRIZXHAOGKS-UHFFFAOYSA-N
MW373.37 g/mol
LogP4.47
Rot. Bonds9

About N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride

N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride (PubChem CID 73348065) has the molecular formula C19H30Cl2N2O and a molecular weight of 373.37 g/mol. Its IUPAC name is N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride
PubChem CID73348065
Molecular FormulaC19H30Cl2N2O
Molecular Weight373.37 g/mol
Exact Mass372.17
IUPAC NameN-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride
SMILESCl.O=C(CCCN1CCCCC1)NCCCCc1ccc(Cl)cc1
InChIInChI=1S/C19H29ClN2O.ClH/c20-18-11-9-17(10-12-18)7-2-3-13-21-19(23)8-6-16-22-14-4-1-5-15-22;/h9-12H,1-8,13-16H2,(H,21,23);1H
InChIKeyRMLMRIZXHAOGKS-UHFFFAOYSA-N
XLogP4.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.37
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride?
The IUPAC name of N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride (CID 73348065) is N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride.
What is the SMILES notation for N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride?
The canonical SMILES for N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride is Cl.O=C(CCCN1CCCCC1)NCCCCc1ccc(Cl)cc1.
What is the InChIKey of N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride?
The InChIKey is RMLMRIZXHAOGKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29ClN2O.ClH/c20-18-11-9-17(10-12-18)7-2-3-13-21-19(23)8-6-16-22-14-4-1-5-15-22;/h9-12H,1-8,13-16H2,(H,21,23);1H.
What are the key properties of N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride?
N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride has a molecular weight of 373.37 g/mol, XLogP of 4.47, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-chlorophenyl)butyl]-4-piperidin-1-ylbutanamide;hydrochloride is sourced from PubChem (CID 73348065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).