2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide

C23H29N3O3 — CID 120668110

IUPAC2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide
SMILESCOc1ccccc1CC(=O)N1CCC(NC(=O)C(N)c2ccc(C)cc2)CC1
InChIInChI=1S/C23H29N3O3/c1-16-7-9-17(10-8-16)22(24)23(28)25-19-11-13-26(14-12-19)21(27)15-18-5-3-4-6-20(18)29-2/h3-10,19,22H,11-15,24H2,1-2H3,(H,25,28)
InChIKeyFRKYGSNKXNPHAY-UHFFFAOYSA-N
MW395.50 g/mol
LogP2.35
Rot. Bonds6

About 2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide

2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide (PubChem CID 120668110) has the molecular formula C23H29N3O3 and a molecular weight of 395.50 g/mol. Its IUPAC name is 2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide
PubChem CID120668110
Molecular FormulaC23H29N3O3
Molecular Weight395.50 g/mol
Exact Mass395.22
IUPAC Name2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide
SMILESCOc1ccccc1CC(=O)N1CCC(NC(=O)C(N)c2ccc(C)cc2)CC1
InChIInChI=1S/C23H29N3O3/c1-16-7-9-17(10-8-16)22(24)23(28)25-19-11-13-26(14-12-19)21(27)15-18-5-3-4-6-20(18)29-2/h3-10,19,22H,11-15,24H2,1-2H3,(H,25,28)
InChIKeyFRKYGSNKXNPHAY-UHFFFAOYSA-N
XLogP2.35
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.50
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]propanamide
CID 119312121
(2S)-2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-3-methylbutanamide;hydrochloride
CID 119312142
2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120791121
N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]butanamide
CID 52605797
N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-4-phenylbenzamide
CID 52820081
N-cyclopropyl-2-[4-[2-(2-methoxyphenyl)acetyl]piperazin-1-yl]propanamide
CID 51329083
3-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-4-methylbenzamide;hydrochloride
CID 86813960
1-[4-[2-(2-methoxyphenyl)acetyl]piperazin-1-yl]-2-(4-methylphenyl)ethanone
CID 110818906
3-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]benzamide
CID 119763945
2-amino-2-(4-methylphenyl)-N-(1-phenylpiperidin-4-yl)acetamide
CID 120669904
3-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]cyclohexane-1-carboxamide
CID 119763933
3-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119763931

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide?
The IUPAC name of 2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide (CID 120668110) is 2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for 2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide is COc1ccccc1CC(=O)N1CCC(NC(=O)C(N)c2ccc(C)cc2)CC1.
What is the InChIKey of 2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide?
The InChIKey is FRKYGSNKXNPHAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O3/c1-16-7-9-17(10-8-16)22(24)23(28)25-19-11-13-26(14-12-19)21(27)15-18-5-3-4-6-20(18)29-2/h3-10,19,22H,11-15,24H2,1-2H3,(H,25,28).
What are the key properties of 2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide?
2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide has a molecular weight of 395.50 g/mol, XLogP of 2.35, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 120668110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).