N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide

C15H22N2O2 — CID 99777488

IUPACN-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide
SMILESC[C@H](NCC(=O)N(C)c1ccccc1)[C@H]1CCCO1
InChIInChI=1S/C15H22N2O2/c1-12(14-9-6-10-19-14)16-11-15(18)17(2)13-7-4-3-5-8-13/h3-5,7-8,12,14,16H,6,9-11H2,1-2H3/t12-,14+/m0/s1
InChIKeyRZCAUXHNAACWJN-GXTWGEPZSA-N
MW262.35 g/mol
LogP1.81
Rot. Bonds5

About N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide

N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide (PubChem CID 99777488) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide.

Molecular Properties

Compound NameN-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide
PubChem CID99777488
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide
SMILESC[C@H](NCC(=O)N(C)c1ccccc1)[C@H]1CCCO1
InChIInChI=1S/C15H22N2O2/c1-12(14-9-6-10-19-14)16-11-15(18)17(2)13-7-4-3-5-8-13/h3-5,7-8,12,14,16H,6,9-11H2,1-2H3/t12-,14+/m0/s1
InChIKeyRZCAUXHNAACWJN-GXTWGEPZSA-N
XLogP1.81
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(1R)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide
CID 93103707
N-(2-chlorophenyl)-2-[1-(oxolan-2-yl)ethylamino]acetamide
CID 43534114
(2R)-2-amino-N-[1-(oxolan-2-yl)ethyl]-3-phenylpropanamide
CID 78985428
N-methyl-2-[2-(oxolan-2-ylmethoxy)anilino]-N-phenylacetamide
CID 54829826
N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]-3-phenylpropanamide
CID 7346632
2-amino-N-[1-(oxolan-2-yl)ethyl]-4-phenylbutanamide
CID 114925311
2-(cyclopropylmethylamino)-N-methyl-N-phenylacetamide
CID 60842442
2,4-dimethyl-2-[1-(oxolan-2-yl)ethylamino]pentanoic acid
CID 114994031
N-(5-chloro-2-methylphenyl)-2-[1-(oxolan-2-yl)ethylamino]acetamide
CID 43626479
1-[1-(oxolan-2-yl)ethyl]-3-(4-phenylbutan-2-yl)urea
CID 134006695
1-[1-(oxolan-2-yl)ethylamino]-3-phenoxypropan-2-ol
CID 54938328
2-amino-N-[1-(oxolan-2-yl)ethyl]-2-phenylacetamide;hydrochloride
CID 119292175

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide?
The IUPAC name of N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide (CID 99777488) is N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide.
What is the SMILES notation for N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide?
The canonical SMILES for N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide is C[C@H](NCC(=O)N(C)c1ccccc1)[C@H]1CCCO1.
What is the InChIKey of N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide?
The InChIKey is RZCAUXHNAACWJN-GXTWGEPZSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12(14-9-6-10-19-14)16-11-15(18)17(2)13-7-4-3-5-8-13/h3-5,7-8,12,14,16H,6,9-11H2,1-2H3/t12-,14+/m0/s1.
What are the key properties of N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide?
N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide has a molecular weight of 262.35 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]-N-phenylacetamide is sourced from PubChem (CID 99777488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).