N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine

C19H21N — CID 61034448

IUPACN-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine
SMILESc1cc(CNC2CC2)cc(-c2ccc3c(c2)CCC3)c1
InChIInChI=1S/C19H21N/c1-3-14(13-20-19-9-10-19)11-16(5-1)18-8-7-15-4-2-6-17(15)12-18/h1,3,5,7-8,11-12,19-20H,2,4,6,9-10,13H2
InChIKeyCPHXJGBQUORLEX-UHFFFAOYSA-N
MW263.38 g/mol
LogP4.09
Rot. Bonds4

About N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine

N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine (PubChem CID 61034448) has the molecular formula C19H21N and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine
PubChem CID61034448
Molecular FormulaC19H21N
Molecular Weight263.38 g/mol
Exact Mass263.17
IUPAC NameN-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine
SMILESc1cc(CNC2CC2)cc(-c2ccc3c(c2)CCC3)c1
InChIInChI=1S/C19H21N/c1-3-14(13-20-19-9-10-19)11-16(5-1)18-8-7-15-4-2-6-17(15)12-18/h1,3,5,7-8,11-12,19-20H,2,4,6,9-10,13H2
InChIKeyCPHXJGBQUORLEX-UHFFFAOYSA-N
XLogP4.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[4-(2,3-dihydro-1H-inden-5-yl)-2-fluorophenyl]methyl]cyclopropanamine
CID 63428334
N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]propan-1-amine
CID 63428115
N-[[3-(3,5-dimethylphenyl)phenyl]methyl]cyclopropanamine
CID 54912714
N-[[3-(3,4,5-trifluorophenyl)phenyl]methyl]cyclopropanamine
CID 61239688
N-[[3-(3,4-dihydro-2H-chromen-8-yl)phenyl]methyl]cyclopropanamine
CID 114746607
[3-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]methanamine
CID 61032630
[3-[[[1-(2,3-dihydro-1H-inden-5-yl)piperidin-4-yl]amino]methyl]phenyl]methanol
CID 131889725
N-[[3-(2-cyclobutylphenyl)phenyl]methyl]cyclopropanamine
CID 114605475
N-[[5-(2,3-dihydro-1H-inden-5-yl)-1,3,4-oxadiazol-2-yl]methyl]cyclopropanamine
CID 62136870
N-[[5-(2,3-dihydro-1H-inden-5-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 65184355
N-(2,3-dihydro-1H-inden-5-ylmethyl)thian-3-amine
CID 113250129
N-[(3-iodophenyl)methyl]cyclopropanamine
CID 21107262

Frequently Asked Questions

What is the IUPAC name of N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine?
The IUPAC name of N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine (CID 61034448) is N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine is c1cc(CNC2CC2)cc(-c2ccc3c(c2)CCC3)c1.
What is the InChIKey of N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine?
The InChIKey is CPHXJGBQUORLEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N/c1-3-14(13-20-19-9-10-19)11-16(5-1)18-8-7-15-4-2-6-17(15)12-18/h1,3,5,7-8,11-12,19-20H,2,4,6,9-10,13H2.
What are the key properties of N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine?
N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine has a molecular weight of 263.38 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(2,3-dihydro-1H-inden-5-yl)phenyl]methyl]cyclopropanamine is sourced from PubChem (CID 61034448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).