N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide

C18H20N2O — CID 106893270

IUPACN-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESCNCc1ccccc1NC(=O)C1Cc2ccccc2C1
InChIInChI=1S/C18H20N2O/c1-19-12-15-8-4-5-9-17(15)20-18(21)16-10-13-6-2-3-7-14(13)11-16/h2-9,16,19H,10-12H2,1H3,(H,20,21)
InChIKeyMQCDXNSKTFLORA-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.76
Rot. Bonds4

About N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide

N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 106893270) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID106893270
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESCNCc1ccccc1NC(=O)C1Cc2ccccc2C1
InChIInChI=1S/C18H20N2O/c1-19-12-15-8-4-5-9-17(15)20-18(21)16-10-13-6-2-3-7-14(13)11-16/h2-9,16,19H,10-12H2,1H3,(H,20,21)
InChIKeyMQCDXNSKTFLORA-UHFFFAOYSA-N
XLogP2.76
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(hydroxymethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 106893200
N-[2-(methylaminomethyl)phenyl]cyclohex-3-ene-1-carboxamide
CID 43601055
N-(2-acetylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106703126
N-(2-ethylphenyl)-3-oxocyclobutane-1-carboxamide
CID 75395648
N-(4-bromo-2-ethylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106703922
N-[2-(methylaminomethyl)phenyl]-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 119437919
N-(2-cyanophenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106737104
2,2-dimethyl-3-[[2-(methylaminomethyl)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 64836949
1-N,4-N-bis(2-ethylphenyl)cyclohexane-1,4-dicarboxamide
CID 40704434
N-[2-(1-bromoethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 106894275
N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 106703935
N-[2-(methylaminomethyl)phenyl]-2-phenylacetamide
CID 43601028

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide (CID 106893270) is N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide is CNCc1ccccc1NC(=O)C1Cc2ccccc2C1.
What is the InChIKey of N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is MQCDXNSKTFLORA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-19-12-15-8-4-5-9-17(15)20-18(21)16-10-13-6-2-3-7-14(13)11-16/h2-9,16,19H,10-12H2,1H3,(H,20,21).
What are the key properties of N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide?
N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 106893270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).