N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide

C14H20N2O2 — CID 65157069

IUPACN-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide
SMILESCCN(C(=O)CC1CCCO1)c1ccccc1N
InChIInChI=1S/C14H20N2O2/c1-2-16(13-8-4-3-7-12(13)15)14(17)10-11-6-5-9-18-11/h3-4,7-8,11H,2,5-6,9-10,15H2,1H3
InChIKeyXKFIAYYLZRHHDC-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.19
Rot. Bonds4

About N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide

N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide (PubChem CID 65157069) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide
PubChem CID65157069
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide
SMILESCCN(C(=O)CC1CCCO1)c1ccccc1N
InChIInChI=1S/C14H20N2O2/c1-2-16(13-8-4-3-7-12(13)15)14(17)10-11-6-5-9-18-11/h3-4,7-8,11H,2,5-6,9-10,15H2,1H3
InChIKeyXKFIAYYLZRHHDC-UHFFFAOYSA-N
XLogP2.19
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(2-aminophenyl)-N-propyloxolane-2-carboxamide
CID 63230184
N-(2-aminophenyl)-2-(2-bicyclo[2.2.1]heptanyl)-N-ethylacetamide
CID 62102464
2-N-(oxolan-2-ylmethyl)-2-N-propylbenzene-1,2-diamine
CID 55174589
N-(2-aminophenyl)-N-ethyl-2-(2-methylphenyl)acetamide
CID 62100818
2-(2-aminophenyl)-N-methyl-N-(oxolan-2-ylmethyl)acetamide
CID 61430866
N-(2-aminophenyl)-N-ethyl-2-methoxyacetamide
CID 62100815
2-N-methyl-2-N-(oxan-2-ylmethyl)benzene-1,2-diamine
CID 61431770
N-(2-aminophenyl)-N-(2-hydroxyethyl)-1-(oxolan-2-yl)methanesulfonamide
CID 63246467
2-(4-methyl-N-[2-(oxolan-2-yl)acetyl]anilino)acetic acid
CID 65157371
N-(1-aminopropan-2-yl)-N-methyl-2-(oxolan-2-yl)acetamide;hydrochloride
CID 119260859
N-benzyl-N-methyl-2-(oxan-2-yl)acetamide
CID 110409576
3-amino-4-(dimethylamino)-N-ethyl-N-(oxolan-2-ylmethyl)benzamide
CID 61433455

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide?
The IUPAC name of N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide (CID 65157069) is N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide.
What is the SMILES notation for N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide?
The canonical SMILES for N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide is CCN(C(=O)CC1CCCO1)c1ccccc1N.
What is the InChIKey of N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide?
The InChIKey is XKFIAYYLZRHHDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-2-16(13-8-4-3-7-12(13)15)14(17)10-11-6-5-9-18-11/h3-4,7-8,11H,2,5-6,9-10,15H2,1H3.
What are the key properties of N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide?
N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide has a molecular weight of 248.33 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-N-ethyl-2-(oxolan-2-yl)acetamide is sourced from PubChem (CID 65157069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).