2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine

C19H23NO — CID 43100217

IUPAC2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine
SMILESCc1ccc(C(C)C)c(OC2Cc3ccccc3C2N)c1
InChIInChI=1S/C19H23NO/c1-12(2)15-9-8-13(3)10-17(15)21-18-11-14-6-4-5-7-16(14)19(18)20/h4-10,12,18-19H,11,20H2,1-3H3
InChIKeyJHLLVZDPBKDBEM-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.12
Rot. Bonds3

About 2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine

2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine (PubChem CID 43100217) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine
PubChem CID43100217
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine
SMILESCc1ccc(C(C)C)c(OC2Cc3ccccc3C2N)c1
InChIInChI=1S/C19H23NO/c1-12(2)15-9-8-13(3)10-17(15)21-18-11-14-6-4-5-7-16(14)19(18)20/h4-10,12,18-19H,11,20H2,1-3H3
InChIKeyJHLLVZDPBKDBEM-UHFFFAOYSA-N
XLogP4.12
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(2-chloro-4-methylphenoxy)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 62671113
2-naphthalen-1-yloxy-2,3-dihydro-1H-inden-1-amine
CID 43100876
3-(5-methyl-2-propan-2-ylphenoxy)cyclopentan-1-amine
CID 79643944
2-(5-methyl-2-propan-2-ylphenoxy)-4-propan-2-ylcyclohexan-1-ol
CID 63472349
3-(5-methyl-2-propan-2-ylphenoxy)cyclohexan-1-amine
CID 79618661
4-(5-methyl-2-propan-2-ylphenoxy)piperidine
CID 24708982
6-[(1-amino-2,3-dihydro-1H-inden-2-yl)oxy]-2-methylpyridazin-3-one
CID 126954659
2-(1,3-thiazol-2-yloxy)-2,3-dihydro-1H-inden-1-amine
CID 126953989
2-[2-[(1S)-1-aminoethyl]-5-methylphenoxy]cyclohexan-1-ol
CID 78947415
2-(5-methyl-2-propan-2-ylphenoxy)-1-phenylethanamine
CID 43100574
N-methyl-3-(5-methyl-2-propan-2-ylphenoxy)-2-propoxycyclobutan-1-amine
CID 107943203
2-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]-3,4-dihydro-1H-isoquinoline;hydrochloride
CID 2944173

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine (CID 43100217) is 2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine is Cc1ccc(C(C)C)c(OC2Cc3ccccc3C2N)c1.
What is the InChIKey of 2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is JHLLVZDPBKDBEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-12(2)15-9-8-13(3)10-17(15)21-18-11-14-6-4-5-7-16(14)19(18)20/h4-10,12,18-19H,11,20H2,1-3H3.
What are the key properties of 2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine?
2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 281.40 g/mol, XLogP of 4.12, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2-propan-2-ylphenoxy)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 43100217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).