2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride

C14H21ClN2O — CID 166436266

IUPAC2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride
SMILESCl.O=C(Cc1ccccc1)NC[C@@H]1CCCNC1
InChIInChI=1S/C14H20N2O.ClH/c17-14(9-12-5-2-1-3-6-12)16-11-13-7-4-8-15-10-13;/h1-3,5-6,13,15H,4,7-11H2,(H,16,17);1H/t13-;/m1./s1
InChIKeyXFKYVQKSQQCPIG-BTQNPOSSSA-N
MW268.79 g/mol
LogP1.77
Rot. Bonds4

About 2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride

2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride (PubChem CID 166436266) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is 2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride
PubChem CID166436266
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC Name2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride
SMILESCl.O=C(Cc1ccccc1)NC[C@@H]1CCCNC1
InChIInChI=1S/C14H20N2O.ClH/c17-14(9-12-5-2-1-3-6-12)16-11-13-7-4-8-15-10-13;/h1-3,5-6,13,15H,4,7-11H2,(H,16,17);1H/t13-;/m1./s1
InChIKeyXFKYVQKSQQCPIG-BTQNPOSSSA-N
XLogP1.77
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromophenyl)-N-(piperidin-3-ylmethyl)acetamide;hydrochloride
CID 75417754
2-(3-iodophenyl)-N-(piperidin-3-ylmethyl)acetamide;hydrochloride
CID 119460923
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
2-benzyl-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462305
3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide
CID 119461064
2-(4-benzylpiperazin-1-yl)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride
CID 119460597
1-(2-phenylethyl)-3-[[(3S)-piperidin-3-yl]methyl]urea;hydrochloride
CID 165429715
N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]-2-phenylacetamide
CID 119555564
N-(cycloheptylmethyl)-2-phenylacetamide
CID 54313529
2-(4-benzylpiperazin-1-yl)-N-(piperidin-3-ylmethyl)acetamide
CID 119460598
N-(piperidin-3-ylmethyl)-2-[4-(trifluoromethoxy)phenyl]acetamide;hydrochloride
CID 119464429
2-phenoxy-N-(piperidin-3-ylmethyl)acetamide
CID 60725547

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride?
The IUPAC name of 2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride (CID 166436266) is 2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride?
The canonical SMILES for 2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride is Cl.O=C(Cc1ccccc1)NC[C@@H]1CCCNC1.
What is the InChIKey of 2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride?
The InChIKey is XFKYVQKSQQCPIG-BTQNPOSSSA-N. The full InChI is InChI=1S/C14H20N2O.ClH/c17-14(9-12-5-2-1-3-6-12)16-11-13-7-4-8-15-10-13;/h1-3,5-6,13,15H,4,7-11H2,(H,16,17);1H/t13-;/m1./s1.
What are the key properties of 2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride?
2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride has a molecular weight of 268.79 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride is sourced from PubChem (CID 166436266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).