(2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide

C16H24N2O2 — CID 95907699

IUPAC(2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide
SMILESCO[C@]1(C)C[C@H](N[C@H](C(N)=O)c2ccccc2)C1(C)C
InChIInChI=1S/C16H24N2O2/c1-15(2)12(10-16(15,3)20-4)18-13(14(17)19)11-8-6-5-7-9-11/h5-9,12-13,18H,10H2,1-4H3,(H2,17,19)/t12-,13-,16+/m0/s1
InChIKeyIRMUYHXDHQHPQQ-HEHGZKQESA-N
MW276.38 g/mol
LogP2.01
Rot. Bonds5

About (2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide

(2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide (PubChem CID 95907699) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is (2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide
PubChem CID95907699
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name(2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide
SMILESCO[C@]1(C)C[C@H](N[C@H](C(N)=O)c2ccccc2)C1(C)C
InChIInChI=1S/C16H24N2O2/c1-15(2)12(10-16(15,3)20-4)18-13(14(17)19)11-8-6-5-7-9-11/h5-9,12-13,18H,10H2,1-4H3,(H2,17,19)/t12-,13-,16+/m0/s1
InChIKeyIRMUYHXDHQHPQQ-HEHGZKQESA-N
XLogP2.01
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-N-(3-methoxy-2,2,3-trimethylcyclobutyl)-3-phenylpropanamide;hydrochloride
CID 119343207
2-(chloroamino)-2-phenylacetamide
CID 89152727
2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-2-phenylacetic acid
CID 112633963
N-(2-amino-2-oxo-1-phenylethyl)-4-methoxybenzamide
CID 51315270
(2S)-2-amino-N-(2-amino-2-oxo-1-phenylethyl)propanamide
CID 119276132
methyl 2-[(4-methylcycloheptyl)amino]-2-phenylacetate
CID 65080240
2-(1-cyclopropylethylamino)-2-phenylacetamide
CID 75511506
(2S)-2-[(4,4-dimethylcyclohexyl)methylamino]-2-phenylacetic acid
CID 120511851
2-amino-N-(2-amino-2-oxo-1-phenylethyl)-3-methoxypropanamide;hydrochloride
CID 120984398
(2R)-2-phenyl-2-[[(1S)-1-phenylethyl]amino]acetamide
CID 33398197
2-anilino-2-phenylacetamide;ethane
CID 142824395
methyl (2R)-2-acetamido-2-phenylacetate
CID 10921683

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide?
The IUPAC name of (2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide (CID 95907699) is (2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide.
What is the SMILES notation for (2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide?
The canonical SMILES for (2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide is CO[C@]1(C)C[C@H](N[C@H](C(N)=O)c2ccccc2)C1(C)C.
What is the InChIKey of (2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide?
The InChIKey is IRMUYHXDHQHPQQ-HEHGZKQESA-N. The full InChI is InChI=1S/C16H24N2O2/c1-15(2)12(10-16(15,3)20-4)18-13(14(17)19)11-8-6-5-7-9-11/h5-9,12-13,18H,10H2,1-4H3,(H2,17,19)/t12-,13-,16+/m0/s1.
What are the key properties of (2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide?
(2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide has a molecular weight of 276.38 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[[(1S,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-2-phenylacetamide is sourced from PubChem (CID 95907699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).