4-butyl-2,3-dihydro-1H-inden-1-amine

C13H19N — CID 103852528

IUPAC4-butyl-2,3-dihydro-1H-inden-1-amine
SMILESCCCCc1cccc2c1CCC2N
InChIInChI=1S/C13H19N/c1-2-3-5-10-6-4-7-12-11(10)8-9-13(12)14/h4,6-7,13H,2-3,5,8-9,14H2,1H3
InChIKeyCKAOVYQCUDKPPI-UHFFFAOYSA-N
MW189.30 g/mol
LogP2.98
Rot. Bonds3

About 4-butyl-2,3-dihydro-1H-inden-1-amine

4-butyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 103852528) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 4-butyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name4-butyl-2,3-dihydro-1H-inden-1-amine
PubChem CID103852528
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name4-butyl-2,3-dihydro-1H-inden-1-amine
SMILESCCCCc1cccc2c1CCC2N
InChIInChI=1S/C13H19N/c1-2-3-5-10-6-4-7-12-11(10)8-9-13(12)14/h4,6-7,13H,2-3,5,8-9,14H2,1H3
InChIKeyCKAOVYQCUDKPPI-UHFFFAOYSA-N
XLogP2.98
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-ethyl-2,3-dihydro-1H-inden-1-amine
CID 62390706
(1R)-4-methyl-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 134159261
4-(2-butoxyethoxy)-2,3-dihydro-1H-inden-1-amine
CID 55182395
2-butyl-6-cyclobutylaniline
CID 172550525
2,3-dihydro-1H-indene-1,4-diamine
CID 55293440
4-fluoro-2,3-dihydro-1H-inden-1-amine;methanamine
CID 175262813
N-(1-amino-2,3-dihydro-1H-inden-4-yl)propane-1-sulfonamide
CID 165486719
4-(2-propoxyethoxy)-2,3-dihydro-1H-inden-1-amine
CID 106450266
(1R)-4-trimethylsilyl-2,3-dihydro-1H-inden-1-amine
CID 140770742
N-(1-amino-2,3-dihydro-1H-inden-4-yl)-4-butyl-2-methoxybenzamide
CID 67610252
4-ethyl-1-methyl-2,3-dihydro-1H-indene
CID 178109031
4-(3-butyl-2-methylphenyl)piperidine
CID 130378004

Frequently Asked Questions

What is the IUPAC name of 4-butyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 4-butyl-2,3-dihydro-1H-inden-1-amine (CID 103852528) is 4-butyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 4-butyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 4-butyl-2,3-dihydro-1H-inden-1-amine is CCCCc1cccc2c1CCC2N.
What is the InChIKey of 4-butyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is CKAOVYQCUDKPPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-2-3-5-10-6-4-7-12-11(10)8-9-13(12)14/h4,6-7,13H,2-3,5,8-9,14H2,1H3.
What are the key properties of 4-butyl-2,3-dihydro-1H-inden-1-amine?
4-butyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 189.30 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 103852528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).