N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide

C16H22N2O — CID 115182949

IUPACN-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
SMILESCNCC1(C(=O)N(C)c2ccc3c(c2)CCC3)CC1
InChIInChI=1S/C16H22N2O/c1-17-11-16(8-9-16)15(19)18(2)14-7-6-12-4-3-5-13(12)10-14/h6-7,10,17H,3-5,8-9,11H2,1-2H3
InChIKeyBNDMCAOCRMUFSO-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.14
Rot. Bonds4

About N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide

N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide (PubChem CID 115182949) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
PubChem CID115182949
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
SMILESCNCC1(C(=O)N(C)c2ccc3c(c2)CCC3)CC1
InChIInChI=1S/C16H22N2O/c1-17-11-16(8-9-16)15(19)18(2)14-7-6-12-4-3-5-13(12)10-14/h6-7,10,17H,3-5,8-9,11H2,1-2H3
InChIKeyBNDMCAOCRMUFSO-UHFFFAOYSA-N
XLogP2.14
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(methylaminomethyl)-N-(4-methylphenyl)cyclopropane-1-carboxamide
CID 115182934
N-(4-bromophenyl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
CID 115182941
N-(3-methoxyphenyl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
CID 115182981
N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2,3-dihydro-1H-inden-5-amine
CID 115244605
N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide
CID 115190982
N-(3-methoxyphenyl)-N-methyl-1-(methylaminomethyl)cyclobutane-1-carboxamide
CID 115183686
N-(2,3-dihydro-1H-inden-5-yl)-N-methylcarbamoyl chloride
CID 115194463
N-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 10536160
1-cyano-N-(2,3-dihydro-1H-inden-5-yl)-N-methylformamide
CID 115171972
N-(5-chlorothiophen-2-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
CID 115182952
N-(5-bromo-2-fluorophenyl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide
CID 115182970
N-(3,4-dihydro-2H-chromen-6-yl)-N-methyl-2-(methylamino)acetamide
CID 82496343

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide (CID 115182949) is N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide is CNCC1(C(=O)N(C)c2ccc3c(c2)CCC3)CC1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide?
The InChIKey is BNDMCAOCRMUFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-17-11-16(8-9-16)15(19)18(2)14-7-6-12-4-3-5-13(12)10-14/h6-7,10,17H,3-5,8-9,11H2,1-2H3.
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide?
N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide has a molecular weight of 258.36 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(methylaminomethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 115182949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).