2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide

C10H20F2N2O2 — CID 168940502

IUPAC2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide
SMILESCOCCN(C)C(=O)CN(C(C)C)C(F)F
InChIInChI=1S/C10H20F2N2O2/c1-8(2)14(10(11)12)7-9(15)13(3)5-6-16-4/h8,10H,5-7H2,1-4H3
InChIKeyCVDNALYNHCMLRO-UHFFFAOYSA-N
MW238.28 g/mol
LogP1.02
Rot. Bonds7

About 2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide

2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide (PubChem CID 168940502) has the molecular formula C10H20F2N2O2 and a molecular weight of 238.28 g/mol. Its IUPAC name is 2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide.

Molecular Properties

Compound Name2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide
PubChem CID168940502
Molecular FormulaC10H20F2N2O2
Molecular Weight238.28 g/mol
Exact Mass238.15
IUPAC Name2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide
SMILESCOCCN(C)C(=O)CN(C(C)C)C(F)F
InChIInChI=1S/C10H20F2N2O2/c1-8(2)14(10(11)12)7-9(15)13(3)5-6-16-4/h8,10H,5-7H2,1-4H3
InChIKeyCVDNALYNHCMLRO-UHFFFAOYSA-N
XLogP1.02
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.28
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze 2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide 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

2,2,2-trifluoro-N-(2-methoxyethyl)-N-propan-2-ylacetamide
CID 82960259
2-[1-methoxypropyl(2,2,2-trifluoroethyl)amino]-N,N-dimethylacetamide
CID 142518883
2-[4-(2-methoxyethyl)piperazin-1-yl]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
CID 53533620
2-[4-(2-methoxyethyl)piperazin-1-yl]-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 53535043
2-[(3-amino-1,1,1-trifluoropropan-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 54989201
2-[(4-amino-1,1,1-trifluorobutan-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 54989313
N,N-diethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]propanamide
CID 55031854
N-butan-2-yl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide
CID 55261842
N-(1-methoxypropan-2-yl)-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide
CID 55262034
2-[2-Methoxyethyl(2,2,2-trifluoroethyl)amino]-1-morpholin-4-ylethanone
CID 56805335
N-cyclopropyl-2-[2-methoxyethyl(2,2,2-trifluoroethyl)amino]acetamide
CID 60303341
2-(1-methoxypropan-2-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60648283

Frequently Asked Questions

What is the IUPAC name of 2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide?
The IUPAC name of 2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide (CID 168940502) is 2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide.
What is the SMILES notation for 2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide?
The canonical SMILES for 2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide is COCCN(C)C(=O)CN(C(C)C)C(F)F.
What is the InChIKey of 2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide?
The InChIKey is CVDNALYNHCMLRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F2N2O2/c1-8(2)14(10(11)12)7-9(15)13(3)5-6-16-4/h8,10H,5-7H2,1-4H3.
What are the key properties of 2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide?
2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide has a molecular weight of 238.28 g/mol, XLogP of 1.02, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[difluoromethyl(propan-2-yl)amino]-N-(2-methoxyethyl)-N-methylacetamide is sourced from PubChem (CID 168940502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).