3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride

C21H29ClN2O — CID 119825837

IUPAC3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
SMILESCCCN(C(=O)CCc1ccc2ccccc2c1)C1CCNCC1.Cl
InChIInChI=1S/C21H28N2O.ClH/c1-2-15-23(20-11-13-22-14-12-20)21(24)10-8-17-7-9-18-5-3-4-6-19(18)16-17;/h3-7,9,16,20,22H,2,8,10-15H2,1H3;1H
InChIKeyXOKBTEBTSNUQNI-UHFFFAOYSA-N
MW360.93 g/mol
LogP4.18
Rot. Bonds6

About 3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride

3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride (PubChem CID 119825837) has the molecular formula C21H29ClN2O and a molecular weight of 360.93 g/mol. Its IUPAC name is 3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
PubChem CID119825837
Molecular FormulaC21H29ClN2O
Molecular Weight360.93 g/mol
Exact Mass360.20
IUPAC Name3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
SMILESCCCN(C(=O)CCc1ccc2ccccc2c1)C1CCNCC1.Cl
InChIInChI=1S/C21H28N2O.ClH/c1-2-15-23(20-11-13-22-14-12-20)21(24)10-8-17-7-9-18-5-3-4-6-19(18)16-17;/h3-7,9,16,20,22H,2,8,10-15H2,1H3;1H
InChIKeyXOKBTEBTSNUQNI-UHFFFAOYSA-N
XLogP4.18
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.93
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-nitrophenyl)-N-piperidin-4-yl-N-propylpropanamide
CID 119823365
3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide
CID 119825341
4-(3,4-dichlorophenyl)-N-piperidin-4-yl-N-propylbutanamide;hydrochloride
CID 119824958
4-(3,4-difluorophenyl)-N-piperidin-4-yl-N-propylbutanamide
CID 119824702
N-methyl-2-naphthalen-2-yl-N-piperidin-4-ylacetamide
CID 43602192
5-(4-methylphenyl)-N-piperidin-4-yl-N-propylpentanamide
CID 119823684
N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide
CID 62365720
3-(2-methylphenyl)-N-propyl-N-pyrrolidin-3-ylpropanamide
CID 62367590
3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119824116
2-(2-phenylethoxy)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
CID 119825872
2-phenyl-N-propyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119532603
N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide
CID 119825481

Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride?
The IUPAC name of 3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride (CID 119825837) is 3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride.
What is the SMILES notation for 3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride?
The canonical SMILES for 3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride is CCCN(C(=O)CCc1ccc2ccccc2c1)C1CCNCC1.Cl.
What is the InChIKey of 3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride?
The InChIKey is XOKBTEBTSNUQNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O.ClH/c1-2-15-23(20-11-13-22-14-12-20)21(24)10-8-17-7-9-18-5-3-4-6-19(18)16-17;/h3-7,9,16,20,22H,2,8,10-15H2,1H3;1H.
What are the key properties of 3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride?
3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride has a molecular weight of 360.93 g/mol, XLogP of 4.18, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride is sourced from PubChem (CID 119825837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).