N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide

C14H20N2O2 — CID 78940669

IUPACN-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide
SMILESC[C@H](O)c1ccccc1N(C)CC(=O)NC1CC1
InChIInChI=1S/C14H20N2O2/c1-10(17)12-5-3-4-6-13(12)16(2)9-14(18)15-11-7-8-11/h3-6,10-11,17H,7-9H2,1-2H3,(H,15,18)/t10-/m0/s1
InChIKeySZYSSOGBRZWLDG-JTQLQIEISA-N
MW248.33 g/mol
LogP1.45
Rot. Bonds5

About N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide

N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide (PubChem CID 78940669) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide
PubChem CID78940669
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide
SMILESC[C@H](O)c1ccccc1N(C)CC(=O)NC1CC1
InChIInChI=1S/C14H20N2O2/c1-10(17)12-5-3-4-6-13(12)16(2)9-14(18)15-11-7-8-11/h3-6,10-11,17H,7-9H2,1-2H3,(H,15,18)/t10-/m0/s1
InChIKeySZYSSOGBRZWLDG-JTQLQIEISA-N
XLogP1.45
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-[[3-[(1S)-1-hydroxyethyl]-2-pyridinyl]-methylamino]acetamide
CID 114055994
2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]-N-propylacetamide
CID 63371318
3-[2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]phenyl]prop-2-enoic acid
CID 76912209
2-chloro-6-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]benzoic acid
CID 55002718
2-[acetyl(1-phenylethyl)amino]-N-cyclopropylacetamide
CID 113161940
2-[[2-[1-(2-chlorophenyl)ethylamino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide
CID 84869554
2-[4-chloro-N-methyl-2-[(propan-2-ylamino)methyl]anilino]-N-cyclopropylacetamide
CID 114850143
2-(5-amino-N,2-dimethylanilino)-N-cyclopropylacetamide
CID 62588683
N-cyclopropyl-2-[4-(hydroxymethyl)-N,2-dimethylanilino]acetamide
CID 62122234
N-cycloheptyl-2-[(3-hydroxy-3-phenylpropyl)-methylamino]acetamide
CID 91835840
methyl 4-amino-3-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]benzoate
CID 82785492
2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide
CID 43575619

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide?
The IUPAC name of N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide (CID 78940669) is N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide is C[C@H](O)c1ccccc1N(C)CC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide?
The InChIKey is SZYSSOGBRZWLDG-JTQLQIEISA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10(17)12-5-3-4-6-13(12)16(2)9-14(18)15-11-7-8-11/h3-6,10-11,17H,7-9H2,1-2H3,(H,15,18)/t10-/m0/s1.
What are the key properties of N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide?
N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[2-[(1S)-1-hydroxyethyl]-N-methylanilino]acetamide is sourced from PubChem (CID 78940669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).