N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine

C19H32N2 — CID 82257057

IUPACN-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine
SMILESCC(Cc1ccc2c(c1)CCN2)NC(C)(C)CC(C)(C)C
InChIInChI=1S/C19H32N2/c1-14(21-19(5,6)13-18(2,3)4)11-15-7-8-17-16(12-15)9-10-20-17/h7-8,12,14,20-21H,9-11,13H2,1-6H3
InChIKeyIZJOSKMYHBOMGB-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.39
Rot. Bonds5

About N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine

N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine (PubChem CID 82257057) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine.

Molecular Properties

Compound NameN-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine
PubChem CID82257057
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC NameN-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine
SMILESCC(Cc1ccc2c(c1)CCN2)NC(C)(C)CC(C)(C)C
InChIInChI=1S/C19H32N2/c1-14(21-19(5,6)13-18(2,3)4)11-15-7-8-17-16(12-15)9-10-20-17/h7-8,12,14,20-21H,9-11,13H2,1-6H3
InChIKeyIZJOSKMYHBOMGB-UHFFFAOYSA-N
XLogP4.39
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine?
The IUPAC name of N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine (CID 82257057) is N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine.
What is the SMILES notation for N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine?
The canonical SMILES for N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine is CC(Cc1ccc2c(c1)CCN2)NC(C)(C)CC(C)(C)C.
What is the InChIKey of N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine?
The InChIKey is IZJOSKMYHBOMGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-14(21-19(5,6)13-18(2,3)4)11-15-7-8-17-16(12-15)9-10-20-17/h7-8,12,14,20-21H,9-11,13H2,1-6H3.
What are the key properties of N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine?
N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine has a molecular weight of 288.48 g/mol, XLogP of 4.39, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine is sourced from PubChem (CID 82257057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).