N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride

C16H29Cl2N3O — CID 120654368

IUPACN-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride
SMILESCCN[C@H](C)CNC(=O)C(c1ccccc1)N(C)CC.Cl.Cl
InChIInChI=1S/C16H27N3O.2ClH/c1-5-17-13(3)12-18-16(20)15(19(4)6-2)14-10-8-7-9-11-14;;/h7-11,13,15,17H,5-6,12H2,1-4H3,(H,18,20);2*1H/t13-,15?;;/m1../s1
InChIKeyZFCRFPSJPIDMKO-RSZRSJCOSA-N
MW350.33 g/mol
LogP2.64
Rot. Bonds8

About N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride

N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride (PubChem CID 120654368) has the molecular formula C16H29Cl2N3O and a molecular weight of 350.33 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride
PubChem CID120654368
Molecular FormulaC16H29Cl2N3O
Molecular Weight350.33 g/mol
Exact Mass349.17
IUPAC NameN-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride
SMILESCCN[C@H](C)CNC(=O)C(c1ccccc1)N(C)CC.Cl.Cl
InChIInChI=1S/C16H27N3O.2ClH/c1-5-17-13(3)12-18-16(20)15(19(4)6-2)14-10-8-7-9-11-14;;/h7-11,13,15,17H,5-6,12H2,1-4H3,(H,18,20);2*1H/t13-,15?;;/m1../s1
InChIKeyZFCRFPSJPIDMKO-RSZRSJCOSA-N
XLogP2.64
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.33
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-2-[ethyl(methyl)amino]-2-phenylacetamide
CID 119384601
N-[2-[[(2R)-2-(ethylamino)propyl]amino]-2-oxo-1-phenylethyl]benzamide;hydrochloride
CID 120654480
N-[(2R)-2-(ethylamino)propyl]-3,3-diphenylpropanamide;hydrochloride
CID 120652570
2-benzyl-N-[(2R)-2-(ethylamino)propyl]-3-methylbutanamide;hydrochloride
CID 120651072
2-[ethyl(methyl)amino]-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-phenylacetamide;dihydrochloride
CID 120943741
N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide
CID 71933759
2-[ethyl(methyl)amino]-2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]acetamide
CID 56521548
(1R)-1-[ethyl(methyl)amino]-1-phenylpropan-2-one
CID 66831262
N-[(2R)-2-(ethylamino)propyl]-2-(2-fluorophenyl)sulfanyl-2-phenylacetamide;hydrochloride
CID 120653440
(2R)-2-(dimethylamino)-2-phenyl-N-[(2R)-2-phenylpropyl]acetamide
CID 99645937
N-[(2R)-2-(ethylamino)propyl]-4-methyl-3-phenylpentanamide
CID 120654213
2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide
CID 111115516

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride (CID 120654368) is N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride is CCN[C@H](C)CNC(=O)C(c1ccccc1)N(C)CC.Cl.Cl.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride?
The InChIKey is ZFCRFPSJPIDMKO-RSZRSJCOSA-N. The full InChI is InChI=1S/C16H27N3O.2ClH/c1-5-17-13(3)12-18-16(20)15(19(4)6-2)14-10-8-7-9-11-14;;/h7-11,13,15,17H,5-6,12H2,1-4H3,(H,18,20);2*1H/t13-,15?;;/m1../s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride?
N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride has a molecular weight of 350.33 g/mol, XLogP of 2.64, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(ethylamino)propyl]-2-[ethyl(methyl)amino]-2-phenylacetamide;dihydrochloride is sourced from PubChem (CID 120654368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).