3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine

C13H19NO — CID 61354580

IUPAC3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine
SMILESCC(N)C(C)Oc1ccc2c(c1)CCC2
InChIInChI=1S/C13H19NO/c1-9(14)10(2)15-13-7-6-11-4-3-5-12(11)8-13/h6-10H,3-5,14H2,1-2H3
InChIKeyNQXQJEIEFQUATN-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.29
Rot. Bonds3

About 3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine

3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine (PubChem CID 61354580) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine.

Molecular Properties

Compound Name3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine
PubChem CID61354580
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine
SMILESCC(N)C(C)Oc1ccc2c(c1)CCC2
InChIInChI=1S/C13H19NO/c1-9(14)10(2)15-13-7-6-11-4-3-5-12(11)8-13/h6-10H,3-5,14H2,1-2H3
InChIKeyNQXQJEIEFQUATN-UHFFFAOYSA-N
XLogP2.29
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dihydro-1H-inden-5-yloxy)-3-methylbutanamide
CID 82041277
2-(2,3-dihydro-1H-inden-5-yloxy)-3-methylbutan-1-amine
CID 62459614
2-(2,3-dihydro-1H-inden-5-yloxy)propanal
CID 126971637
2,3-dihydro-1H-inden-5-yl 2-amino-3-methylbutanoate
CID 82116252
4-(2,3-dihydro-1H-inden-5-yloxy)pentan-2-ol
CID 64719056
6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalene
CID 82076236
N'-hydroxy-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanimidamide
CID 76914985
4-(2,3-dihydro-1H-inden-5-yloxy)-N-methylpentan-1-amine
CID 62460723
2,3-dihydro-1H-inden-5-yl N-propan-2-ylcarbamate
CID 127549123
N-[2-(2,3-dihydro-1H-inden-5-yloxy)propyl]aniline
CID 62598550
1-[3-(2,3-dihydro-1H-inden-5-yloxy)phenyl]propan-2-amine
CID 63942350
2-(2,3-dihydro-1H-inden-5-yloxy)-1-(4-methylphenyl)propan-1-one
CID 43411837

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine?
The IUPAC name of 3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine (CID 61354580) is 3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine.
What is the SMILES notation for 3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine?
The canonical SMILES for 3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine is CC(N)C(C)Oc1ccc2c(c1)CCC2.
What is the InChIKey of 3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine?
The InChIKey is NQXQJEIEFQUATN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-9(14)10(2)15-13-7-6-11-4-3-5-12(11)8-13/h6-10H,3-5,14H2,1-2H3.
What are the key properties of 3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine?
3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine has a molecular weight of 205.30 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine is sourced from PubChem (CID 61354580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).