N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride

C13H19ClN2O — CID 155657873

IUPACN-(1-phenylpiperidin-4-yl)acetamide;hydrochloride
SMILESCC(=O)NC1CCN(c2ccccc2)CC1.Cl
InChIInChI=1S/C13H18N2O.ClH/c1-11(16)14-12-7-9-15(10-8-12)13-5-3-2-4-6-13;/h2-6,12H,7-10H2,1H3,(H,14,16);1H
InChIKeyXQNHCDUEKBDQQM-UHFFFAOYSA-N
MW254.76 g/mol
LogP2.21
Rot. Bonds2

About N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride

N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride (PubChem CID 155657873) has the molecular formula C13H19ClN2O and a molecular weight of 254.76 g/mol. Its IUPAC name is N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(1-phenylpiperidin-4-yl)acetamide;hydrochloride
PubChem CID155657873
Molecular FormulaC13H19ClN2O
Molecular Weight254.76 g/mol
Exact Mass254.12
IUPAC NameN-(1-phenylpiperidin-4-yl)acetamide;hydrochloride
SMILESCC(=O)NC1CCN(c2ccccc2)CC1.Cl
InChIInChI=1S/C13H18N2O.ClH/c1-11(16)14-12-7-9-15(10-8-12)13-5-3-2-4-6-13;/h2-6,12H,7-10H2,1H3,(H,14,16);1H
InChIKeyXQNHCDUEKBDQQM-UHFFFAOYSA-N
XLogP2.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.76
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-aminophenyl)pyrrolidin-3-yl]acetamide;dihydrochloride
CID 21087634
3-amino-N-(1-phenylpiperidin-4-yl)butanamide;dihydrochloride
CID 119863025
N-[1-[3-(aminomethyl)phenyl]piperidin-4-yl]acetamide
CID 102814279
1-(1-phenylpiperidin-4-yl)-3-(thietan-3-yl)urea
CID 136562095
1-cyclopropyl-3-[(3S)-1-phenylpyrrolidin-3-yl]urea
CID 95312527
(2S)-2-acetamido-N-(1-phenylpiperidin-4-yl)pentanediamide
CID 91780032
N-[1-[4-(trifluoromethoxy)phenyl]piperidin-4-yl]acetamide
CID 60583825
2-amino-2-phenyl-N-(1-phenylpiperidin-4-yl)propanamide
CID 120595916
4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide
CID 110745886
4-methylsulfanyl-N-(1-phenylpiperidin-4-yl)benzamide
CID 86828685
3-hydroxy-3-phenyl-N-(1-phenylpiperidin-4-yl)butanamide
CID 86785833
3-methyl-N-(1-phenylpiperidin-4-yl)benzamide
CID 110735842

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride?
The IUPAC name of N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride (CID 155657873) is N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride.
What is the SMILES notation for N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride?
The canonical SMILES for N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride is CC(=O)NC1CCN(c2ccccc2)CC1.Cl.
What is the InChIKey of N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride?
The InChIKey is XQNHCDUEKBDQQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O.ClH/c1-11(16)14-12-7-9-15(10-8-12)13-5-3-2-4-6-13;/h2-6,12H,7-10H2,1H3,(H,14,16);1H.
What are the key properties of N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride?
N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride has a molecular weight of 254.76 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride is sourced from PubChem (CID 155657873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).