N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide

C20H24ClN3O — CID 100803144

IUPACN-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide
SMILESC[C@@H]1CCCCN1c1ccc(N)cc1NC(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C20H24ClN3O/c1-14-4-2-3-11-24(14)19-10-9-17(22)13-18(19)23-20(25)12-15-5-7-16(21)8-6-15/h5-10,13-14H,2-4,11-12,22H2,1H3,(H,23,25)/t14-/m1/s1
InChIKeyGDPZRYIIESQYGH-CQSZACIVSA-N
MW357.89 g/mol
LogP4.48
Rot. Bonds4

About N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide

N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide (PubChem CID 100803144) has the molecular formula C20H24ClN3O and a molecular weight of 357.89 g/mol. Its IUPAC name is N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide
PubChem CID100803144
Molecular FormulaC20H24ClN3O
Molecular Weight357.89 g/mol
Exact Mass357.16
IUPAC NameN-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide
SMILESC[C@@H]1CCCCN1c1ccc(N)cc1NC(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C20H24ClN3O/c1-14-4-2-3-11-24(14)19-10-9-17(22)13-18(19)23-20(25)12-15-5-7-16(21)8-6-15/h5-10,13-14H,2-4,11-12,22H2,1H3,(H,23,25)/t14-/m1/s1
InChIKeyGDPZRYIIESQYGH-CQSZACIVSA-N
XLogP4.48
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.89
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-[5-amino-2-[(2S)-2-methylpiperidin-1-yl]phenyl]-4-chlorobenzamide
CID 100803194
N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]propanamide
CID 100803131
N-[5-amino-2-(2-methylpiperidin-1-yl)phenyl]pentanamide
CID 91675384
N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]hexanamide
CID 100803137
N-[5-amino-2-[(2S)-2-methylpiperidin-1-yl]phenyl]-2-chlorobenzamide
CID 100803176
N-[5-amino-2-[(2S)-2-methylpiperidin-1-yl]phenyl]-3-chloro-4-methylbenzamide
CID 100803211
N-[5-amino-2-(2-methylpiperidin-1-yl)phenyl]benzamide
CID 91675423
N-[5-amino-2-(2-methylpiperidin-1-yl)phenyl]furan-2-carboxamide
CID 91675412
N-[5-amino-2-[(2S)-2-methylpiperidin-1-yl]phenyl]furan-2-carboxamide
CID 100803151
N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-3,5-dichloro-4-methoxybenzamide
CID 100803251
N-[5-amino-2-(2-methylpiperidin-1-yl)phenyl]-2-(3-methylphenoxy)acetamide
CID 91675368
N-[5-amino-2-(2-methylpiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide
CID 91675417

Frequently Asked Questions

What is the IUPAC name of N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide?
The IUPAC name of N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide (CID 100803144) is N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide.
What is the SMILES notation for N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide?
The canonical SMILES for N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide is C[C@@H]1CCCCN1c1ccc(N)cc1NC(=O)Cc1ccc(Cl)cc1.
What is the InChIKey of N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide?
The InChIKey is GDPZRYIIESQYGH-CQSZACIVSA-N. The full InChI is InChI=1S/C20H24ClN3O/c1-14-4-2-3-11-24(14)19-10-9-17(22)13-18(19)23-20(25)12-15-5-7-16(21)8-6-15/h5-10,13-14H,2-4,11-12,22H2,1H3,(H,23,25)/t14-/m1/s1.
What are the key properties of N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide?
N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide has a molecular weight of 357.89 g/mol, XLogP of 4.48, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-amino-2-[(2R)-2-methylpiperidin-1-yl]phenyl]-2-(4-chlorophenyl)acetamide is sourced from PubChem (CID 100803144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).