2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide

C17H27N3O — CID 63906338

IUPAC2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide
SMILESCCNC(CN(CC)c1ccccc1C)(C(N)=O)C1CC1
InChIInChI=1S/C17H27N3O/c1-4-19-17(16(18)21,14-10-11-14)12-20(5-2)15-9-7-6-8-13(15)3/h6-9,14,19H,4-5,10-12H2,1-3H3,(H2,18,21)
InChIKeyXFTNEEAFGBRCFJ-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.06
Rot. Bonds8

About 2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide

2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide (PubChem CID 63906338) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide
PubChem CID63906338
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide
SMILESCCNC(CN(CC)c1ccccc1C)(C(N)=O)C1CC1
InChIInChI=1S/C17H27N3O/c1-4-19-17(16(18)21,14-10-11-14)12-20(5-2)15-9-7-6-8-13(15)3/h6-9,14,19H,4-5,10-12H2,1-3H3,(H2,18,21)
InChIKeyXFTNEEAFGBRCFJ-UHFFFAOYSA-N
XLogP2.06
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-3-(N-ethyl-2-methylanilino)-2-(methylamino)propanoic acid
CID 63907183
2-cyclopropyl-3-(N-ethyl-2-methylanilino)-2-(methylamino)propan-1-ol
CID 64790377
2-cyclopropyl-3-(N-ethyl-4-methylanilino)-2-(methylamino)propanamide
CID 63919628
2-cyclopropyl-3-[cyclopropyl(ethyl)amino]-2-(ethylamino)propanamide
CID 63911879
2-cyclopropyl-3-(1,3-dihydroisoindol-2-yl)-2-(ethylamino)propanamide
CID 63925390
2-cyclopropyl-2-(ethylamino)-3-[methyl(propan-2-yl)amino]propanamide
CID 63907689
3-[bis(2-methoxyethyl)amino]-2-cyclopropyl-2-(ethylamino)propanamide
CID 63911477
2-cyclopropyl-3-(N-ethyl-4-fluoroanilino)-2-(methylamino)propanamide
CID 63927629
2-cyclopropyl-3-[2-ethoxyethyl(ethyl)amino]-2-(ethylamino)propanamide
CID 63925029
2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-4-fluoroanilino)propanoic acid
CID 63927214
2-cyclopropyl-3-(N,2-dimethylanilino)-2-(methylamino)propanoic acid
CID 63919631
2-cyclopropyl-2-(ethylamino)-3-[(4-ethylcyclohexyl)-methylamino]propanamide
CID 63916269

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide?
The IUPAC name of 2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide (CID 63906338) is 2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide.
What is the SMILES notation for 2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide?
The canonical SMILES for 2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide is CCNC(CN(CC)c1ccccc1C)(C(N)=O)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide?
The InChIKey is XFTNEEAFGBRCFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-4-19-17(16(18)21,14-10-11-14)12-20(5-2)15-9-7-6-8-13(15)3/h6-9,14,19H,4-5,10-12H2,1-3H3,(H2,18,21).
What are the key properties of 2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide?
2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide has a molecular weight of 289.42 g/mol, XLogP of 2.06, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(ethylamino)-3-(N-ethyl-2-methylanilino)propanamide is sourced from PubChem (CID 63906338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).