N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide

C17H24N2O — CID 95578914

IUPACN-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide
SMILESCN(C)[C@@H](CNC(=O)C1(c2ccccc2)CC1)C1CC1
InChIInChI=1S/C17H24N2O/c1-19(2)15(13-8-9-13)12-18-16(20)17(10-11-17)14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3,(H,18,20)/t15-/m0/s1
InChIKeyMLEXJSBOVFYRBD-HNNXBMFYSA-N
MW272.39 g/mol
LogP2.17
Rot. Bonds6

About N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide

N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide (PubChem CID 95578914) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide
PubChem CID95578914
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide
SMILESCN(C)[C@@H](CNC(=O)C1(c2ccccc2)CC1)C1CC1
InChIInChI=1S/C17H24N2O/c1-19(2)15(13-8-9-13)12-18-16(20)17(10-11-17)14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3,(H,18,20)/t15-/m0/s1
InChIKeyMLEXJSBOVFYRBD-HNNXBMFYSA-N
XLogP2.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-hydroxy-2-methylpropyl)-1-phenylcyclopropane-1-carboxamide
CID 65036967
N-[2-(2-aminoethyl)pentyl]-1-phenylcyclopropane-1-carboxamide
CID 106116034
N-[(2R)-2-(ethylamino)propyl]-1-phenylcyclopropane-1-carboxamide
CID 120651845
N-[2-cyclopropyl-2-[(4-phenyloxane-4-carbonyl)amino]ethyl]-4-phenyloxane-4-carboxamide
CID 60615517
N-(4-chloro-2-methylbutyl)-1-phenylcyclopropane-1-carboxamide
CID 113273675
2-methyl-3-[(1-phenylcyclobutanecarbonyl)amino]propanoic acid
CID 55105160
N-[(2R)-2-hydroxy-2-(2-methylphenyl)ethyl]-1-phenylcyclopropane-1-carboxamide
CID 96530875
N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-1-phenylcyclobutane-1-carboxamide
CID 55526819
N-(methoxymethyl)-1-phenylcyclopropane-1-carboxamide
CID 50941599
N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-1-phenylcyclobutane-1-carboxamide
CID 134057340
3-[[2-cyclopropyl-2-(dimethylamino)ethyl]carbamoyl]-1-phenylpyrazole-5-carboxylic acid
CID 138001686
N-[2-hydroxy-3-(2-methylpropoxy)propyl]-1-phenylcyclopropane-1-carboxamide
CID 111662697

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide?
The IUPAC name of N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide (CID 95578914) is N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide is CN(C)[C@@H](CNC(=O)C1(c2ccccc2)CC1)C1CC1.
What is the InChIKey of N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide?
The InChIKey is MLEXJSBOVFYRBD-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-19(2)15(13-8-9-13)12-18-16(20)17(10-11-17)14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3,(H,18,20)/t15-/m0/s1.
What are the key properties of N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide?
N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide has a molecular weight of 272.39 g/mol, XLogP of 2.17, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]-1-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 95578914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).