N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine

C19H23NO — CID 43283537

IUPACN-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine
SMILESCC(C)NCc1ccccc1Oc1ccc2c(c1)CCC2
InChIInChI=1S/C19H23NO/c1-14(2)20-13-17-6-3-4-9-19(17)21-18-11-10-15-7-5-8-16(15)12-18/h3-4,6,9-12,14,20H,5,7-8,13H2,1-2H3
InChIKeyDXYZCOXCVRCZBF-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.47
Rot. Bonds5

About N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine

N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine (PubChem CID 43283537) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine
PubChem CID43283537
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine
SMILESCC(C)NCc1ccccc1Oc1ccc2c(c1)CCC2
InChIInChI=1S/C19H23NO/c1-14(2)20-13-17-6-3-4-9-19(17)21-18-11-10-15-7-5-8-16(15)12-18/h3-4,6,9-12,14,20H,5,7-8,13H2,1-2H3
InChIKeyDXYZCOXCVRCZBF-UHFFFAOYSA-N
XLogP4.47
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine
CID 63551846
N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine
CID 63552028
N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]cyclopropanamine
CID 43283536
N-[[2-(3,4-difluorophenoxy)phenyl]methyl]propan-2-amine
CID 43554911
N-[[2-(1,3-benzodioxol-5-yloxy)phenyl]methyl]propan-2-amine
CID 43282411
(1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol
CID 55183055
N-[(2-pyridin-3-yloxyphenyl)methyl]propan-2-amine
CID 43283723
N-(2,3-dihydro-1H-inden-5-ylmethyl)propan-2-amine
CID 43163778
2-[2-[2-[(propan-2-ylamino)methyl]phenoxy]phenyl]ethanol
CID 107712955
N-[[2-(2,3-dimethylphenoxy)phenyl]methyl]propan-2-amine
CID 43282794
N-[[4-(2,3-dihydro-1H-inden-5-yloxy)-3-pyridinyl]methyl]ethanamine
CID 81250662
3-(2,3-dihydro-1H-inden-5-yloxy)-2-methyl-N-propan-2-ylpropan-1-amine
CID 62459279

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine?
The IUPAC name of N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine (CID 43283537) is N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine?
The canonical SMILES for N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine is CC(C)NCc1ccccc1Oc1ccc2c(c1)CCC2.
What is the InChIKey of N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine?
The InChIKey is DXYZCOXCVRCZBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-14(2)20-13-17-6-3-4-9-19(17)21-18-11-10-15-7-5-8-16(15)12-18/h3-4,6,9-12,14,20H,5,7-8,13H2,1-2H3.
What are the key properties of N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine?
N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine has a molecular weight of 281.40 g/mol, XLogP of 4.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine is sourced from PubChem (CID 43283537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).