N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride

C22H29ClN2O — CID 10156170

IUPACN-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride
SMILESCC(C)N1CCC(N(C)C(=O)Cc2ccc(-c3ccccc3)cc2)C1.Cl
InChIInChI=1S/C22H28N2O.ClH/c1-17(2)24-14-13-21(16-24)23(3)22(25)15-18-9-11-20(12-10-18)19-7-5-4-6-8-19;/h4-12,17,21H,13-16H2,1-3H3;1H
InChIKeyDFXINTVKKHPNGX-UHFFFAOYSA-N
MW372.94 g/mol
LogP4.26
Rot. Bonds5

About N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride

N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride (PubChem CID 10156170) has the molecular formula C22H29ClN2O and a molecular weight of 372.94 g/mol. Its IUPAC name is N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride
PubChem CID10156170
Molecular FormulaC22H29ClN2O
Molecular Weight372.94 g/mol
Exact Mass372.20
IUPAC NameN-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride
SMILESCC(C)N1CCC(N(C)C(=O)Cc2ccc(-c3ccccc3)cc2)C1.Cl
InChIInChI=1S/C22H28N2O.ClH/c1-17(2)24-14-13-21(16-24)23(3)22(25)15-18-9-11-20(12-10-18)19-7-5-4-6-8-19;/h4-12,17,21H,13-16H2,1-3H3;1H
InChIKeyDFXINTVKKHPNGX-UHFFFAOYSA-N
XLogP4.26
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.94
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(cyclopropylmethyl)pyrrolidin-3-yl]-N-methyl-2-(4-phenylphenyl)acetamide
CID 59079688
N-methyl-2-(4-phenylphenyl)-N-piperidin-4-ylacetamide;hydrochloride
CID 119441133
2-(3,4-dichlorophenyl)-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 134046949
N-methyl-3,3-diphenyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide
CID 134046931
N-methyl-2-(2-phenylindol-1-yl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 134047099
N-(1-ethylpiperidin-4-yl)-N-methyl-2-(4-sulfanylphenyl)acetamide
CID 107026586
N,2-bis(4-chlorophenyl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide;hydrochloride
CID 23339055
(2S)-2-amino-N-methyl-3-phenyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide;dihydrochloride
CID 119842325
N,3-dimethyl-2-[(2-phenylacetyl)amino]-N-(1-propan-2-ylpiperidin-4-yl)butanamide
CID 134047108
N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide
CID 79121383
3-amino-N-methyl-2-phenyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide
CID 119842319
1-[(4S)-4-(dimethylamino)azepan-1-yl]-2-(4-phenylphenyl)ethanone
CID 95724805

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride?
The IUPAC name of N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride (CID 10156170) is N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride.
What is the SMILES notation for N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride?
The canonical SMILES for N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride is CC(C)N1CCC(N(C)C(=O)Cc2ccc(-c3ccccc3)cc2)C1.Cl.
What is the InChIKey of N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride?
The InChIKey is DFXINTVKKHPNGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O.ClH/c1-17(2)24-14-13-21(16-24)23(3)22(25)15-18-9-11-20(12-10-18)19-7-5-4-6-8-19;/h4-12,17,21H,13-16H2,1-3H3;1H.
What are the key properties of N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride?
N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride has a molecular weight of 372.94 g/mol, XLogP of 4.26, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-phenylphenyl)-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;hydrochloride is sourced from PubChem (CID 10156170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).