N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride

C17H21ClN2O — CID 20994991

IUPACN-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride
SMILESCN(C)C(CNC(=O)c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C17H20N2O.ClH/c1-19(2)16(14-9-5-3-6-10-14)13-18-17(20)15-11-7-4-8-12-15;/h3-12,16H,13H2,1-2H3,(H,18,20);1H
InChIKeyIQSOVUDOFKVQQG-UHFFFAOYSA-N
MW304.82 g/mol
LogP3.14
Rot. Bonds5

About N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride

N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride (PubChem CID 20994991) has the molecular formula C17H21ClN2O and a molecular weight of 304.82 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride
PubChem CID20994991
Molecular FormulaC17H21ClN2O
Molecular Weight304.82 g/mol
Exact Mass304.13
IUPAC NameN-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride
SMILESCN(C)C(CNC(=O)c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C17H20N2O.ClH/c1-19(2)16(14-9-5-3-6-10-14)13-18-17(20)15-11-7-4-8-12-15;/h3-12,16H,13H2,1-2H3,(H,18,20);1H
InChIKeyIQSOVUDOFKVQQG-UHFFFAOYSA-N
XLogP3.14
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.82
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2R)-2-(dimethylamino)-2-phenylethyl]pyridine-4-carboxamide
CID 32730765
4-tert-butyl-N-[2-(dimethylamino)-2-phenylethyl]benzamide
CID 45001444
N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3-methylbenzamide
CID 2421982
3-(dimethylamino)-N-[2-(dimethylamino)-2-phenylethyl]benzamide
CID 42891486
N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide
CID 7897282
N-[(2R)-2-(dimethylamino)-2-(4-methylphenyl)ethyl]-4-phenylbenzamide
CID 8701383
3-acetamido-N-[(2S)-2-(dimethylamino)-2-phenylethyl]benzamide
CID 27230301
N-[2-(dimethylamino)-2-phenylethyl]-4-(methylsulfonylmethyl)benzamide
CID 51153670
3-acetamido-N-[2-(dimethylamino)-2-phenylethyl]benzamide
CID 42910974
N-[2-(dimethylamino)-2-phenylethyl]-3-pyrrol-1-ylbenzamide
CID 110301921
N-[2-(dimethylamino)-2-phenylethyl]-4-(trifluoromethoxy)benzamide
CID 43001663
4-butoxy-N-[(2R)-2-(dimethylamino)-2-phenylethyl]benzamide
CID 2433841

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride?
The IUPAC name of N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride (CID 20994991) is N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride.
What is the SMILES notation for N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride?
The canonical SMILES for N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride is CN(C)C(CNC(=O)c1ccccc1)c1ccccc1.Cl.
What is the InChIKey of N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride?
The InChIKey is IQSOVUDOFKVQQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O.ClH/c1-19(2)16(14-9-5-3-6-10-14)13-18-17(20)15-11-7-4-8-12-15;/h3-12,16H,13H2,1-2H3,(H,18,20);1H.
What are the key properties of N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride?
N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride has a molecular weight of 304.82 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride is sourced from PubChem (CID 20994991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).