(2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide

C18H31N3O — CID 97017597

IUPAC(2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide
SMILESCC(C)N(CCNC(=O)[C@@H](c1ccccc1)N(C)C)C(C)C
InChIInChI=1S/C18H31N3O/c1-14(2)21(15(3)4)13-12-19-18(22)17(20(5)6)16-10-8-7-9-11-16/h7-11,14-15,17H,12-13H2,1-6H3,(H,19,22)/t17-/m1/s1
InChIKeyMXOAHEQCJGQNKK-QGZVFWFLSA-N
MW305.47 g/mol
LogP2.52
Rot. Bonds8

About (2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide

(2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide (PubChem CID 97017597) has the molecular formula C18H31N3O and a molecular weight of 305.47 g/mol. Its IUPAC name is (2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide
PubChem CID97017597
Molecular FormulaC18H31N3O
Molecular Weight305.47 g/mol
Exact Mass305.25
IUPAC Name(2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide
SMILESCC(C)N(CCNC(=O)[C@@H](c1ccccc1)N(C)C)C(C)C
InChIInChI=1S/C18H31N3O/c1-14(2)21(15(3)4)13-12-19-18(22)17(20(5)6)16-10-8-7-9-11-16/h7-11,14-15,17H,12-13H2,1-6H3,(H,19,22)/t17-/m1/s1
InChIKeyMXOAHEQCJGQNKK-QGZVFWFLSA-N
XLogP2.52
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.47
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(dimethylamino)-2-phenyl-N-[(2R)-2-phenylpropyl]acetamide
CID 99645937
N-[2-[di(propan-2-yl)amino]ethyl]-2-(2-hydroxyphenyl)-2-phenylacetamide;hydrochloride
CID 19743115
3-amino-N-[2-[di(propan-2-yl)amino]ethyl]-3-phenylpropanamide
CID 24694165
2-(dimethylamino)-2-phenyl-N-(1-phenylethyl)acetamide
CID 47839311
N-butan-2-yl-2-(dimethylamino)-2-phenylacetamide
CID 110406838
N-(2-aminoethyl)-2-[ethyl(methyl)amino]-2-phenylacetamide
CID 119384601
1-[2-[di(propan-2-yl)amino]ethyl]-3-[[2-(hydroxymethyl)phenyl]methyl]urea
CID 110911654
2-phenyl-2-[propan-2-yl(propyl)amino]acetohydrazide
CID 63573273
2-chloro-N-[2-[methyl(propan-2-yl)amino]ethyl]-2-phenylacetamide
CID 62640904
(2R)-N-(cyclohexylmethyl)-2-(dimethylamino)-2-phenylacetamide
CID 100566223
N-(2-bromophenyl)-2-(dimethylamino)-2-phenylacetamide
CID 110425843
2-(dimethylamino)-N-[3-(4-fluorophenoxy)propyl]-2-phenylacetamide
CID 110627301

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide?
The IUPAC name of (2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide (CID 97017597) is (2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide.
What is the SMILES notation for (2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide?
The canonical SMILES for (2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide is CC(C)N(CCNC(=O)[C@@H](c1ccccc1)N(C)C)C(C)C.
What is the InChIKey of (2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide?
The InChIKey is MXOAHEQCJGQNKK-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H31N3O/c1-14(2)21(15(3)4)13-12-19-18(22)17(20(5)6)16-10-8-7-9-11-16/h7-11,14-15,17H,12-13H2,1-6H3,(H,19,22)/t17-/m1/s1.
What are the key properties of (2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide?
(2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide has a molecular weight of 305.47 g/mol, XLogP of 2.52, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(dimethylamino)-N-[2-[di(propan-2-yl)amino]ethyl]-2-phenylacetamide is sourced from PubChem (CID 97017597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).