2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide

C20H32N2O2 — CID 97260970

IUPAC2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
SMILESCOC[C@H](NCC(=O)Nc1c(C(C)C)cccc1C(C)C)C1CC1
InChIInChI=1S/C20H32N2O2/c1-13(2)16-7-6-8-17(14(3)4)20(16)22-19(23)11-21-18(12-24-5)15-9-10-15/h6-8,13-15,18,21H,9-12H2,1-5H3,(H,22,23)/t18-/m0/s1
InChIKeyIEANMTUEEWFUBU-SFHVURJKSA-N
MW332.49 g/mol
LogP3.89
Rot. Bonds9

About 2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide

2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide (PubChem CID 97260970) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is 2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
PubChem CID97260970
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC Name2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
SMILESCOC[C@H](NCC(=O)Nc1c(C(C)C)cccc1C(C)C)C1CC1
InChIInChI=1S/C20H32N2O2/c1-13(2)16-7-6-8-17(14(3)4)20(16)22-19(23)11-21-18(12-24-5)15-9-10-15/h6-8,13-15,18,21H,9-12H2,1-5H3,(H,22,23)/t18-/m0/s1
InChIKeyIEANMTUEEWFUBU-SFHVURJKSA-N
XLogP3.89
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2,6-di(propan-2-yl)phenyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119671524
N-[2,6-di(propan-2-yl)phenyl]-2-[[(1R)-1-(2-methoxyphenyl)ethyl]amino]acetamide
CID 7986587
N-[2,6-di(propan-2-yl)phenyl]-2-(1-phenylethylamino)acetamide
CID 4877514
N-[2,6-di(propan-2-yl)phenyl]-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131955
2-[bis(2-methoxyethyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 33483708
2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 9307339
N-[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl]-2-methylpropanamide
CID 113000636
N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-3-methoxypropyl)-methylamino]acetamide
CID 111462499
2-chloro-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 2363774
N-[2,6-di(propan-2-yl)phenyl]-2-(2-methoxyphenyl)acetamide
CID 4793295
N-[2,6-di(propan-2-yl)phenyl]-2-[[(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 19874968
N-[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl]butanamide
CID 113000635

Frequently Asked Questions

What is the IUPAC name of 2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide?
The IUPAC name of 2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide (CID 97260970) is 2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide.
What is the SMILES notation for 2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide?
The canonical SMILES for 2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide is COC[C@H](NCC(=O)Nc1c(C(C)C)cccc1C(C)C)C1CC1.
What is the InChIKey of 2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide?
The InChIKey is IEANMTUEEWFUBU-SFHVURJKSA-N. The full InChI is InChI=1S/C20H32N2O2/c1-13(2)16-7-6-8-17(14(3)4)20(16)22-19(23)11-21-18(12-24-5)15-9-10-15/h6-8,13-15,18,21H,9-12H2,1-5H3,(H,22,23)/t18-/m0/s1.
What are the key properties of 2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide?
2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide has a molecular weight of 332.49 g/mol, XLogP of 3.89, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1R)-1-cyclopropyl-2-methoxyethyl]amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide is sourced from PubChem (CID 97260970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).