2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine

C14H19BrN2 — CID 117122810

IUPAC2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine
SMILESCC(CN)c1cc2ccc(Br)cc2n1C(C)C
InChIInChI=1S/C14H19BrN2/c1-9(2)17-13(10(3)8-16)6-11-4-5-12(15)7-14(11)17/h4-7,9-10H,8,16H2,1-3H3
InChIKeyFSKYSJCTAJOIBY-UHFFFAOYSA-N
MW295.22 g/mol
LogP4.05
Rot. Bonds3

About 2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine

2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine (PubChem CID 117122810) has the molecular formula C14H19BrN2 and a molecular weight of 295.22 g/mol. Its IUPAC name is 2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine.

Molecular Properties

Compound Name2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine
PubChem CID117122810
Molecular FormulaC14H19BrN2
Molecular Weight295.22 g/mol
Exact Mass294.07
IUPAC Name2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine
SMILESCC(CN)c1cc2ccc(Br)cc2n1C(C)C
InChIInChI=1S/C14H19BrN2/c1-9(2)17-13(10(3)8-16)6-11-4-5-12(15)7-14(11)17/h4-7,9-10H,8,16H2,1-3H3
InChIKeyFSKYSJCTAJOIBY-UHFFFAOYSA-N
XLogP4.05
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.22
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-ol
CID 117122779
2-(6-bromo-1-benzothiophen-2-yl)propan-1-amine
CID 115004493
2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol
CID 117122777
1-(6-chloro-1-propan-2-ylindol-2-yl)ethanamine
CID 117122793
2-(6-chloro-1-ethylindol-2-yl)propan-1-amine
CID 117122802
1-(6-bromo-1-methylindol-2-yl)-N-methylethanamine
CID 84640411
3-(5-bromo-1-propan-2-ylindol-2-yl)propan-1-amine
CID 117121603
2-(6-bromo-1-methylindol-2-yl)propanoic acid
CID 117122840
2-amino-2-(6-bromo-1-ethylindol-2-yl)acetic acid
CID 115072292
(2S)-2-(4-bromophenyl)propan-1-amine
CID 23566380
2-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-1-amine
CID 83900924
3-(2-methyl-1-propan-2-ylindol-6-yl)propan-1-amine
CID 117204891

Frequently Asked Questions

What is the IUPAC name of 2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine?
The IUPAC name of 2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine (CID 117122810) is 2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine.
What is the SMILES notation for 2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine?
The canonical SMILES for 2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine is CC(CN)c1cc2ccc(Br)cc2n1C(C)C.
What is the InChIKey of 2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine?
The InChIKey is FSKYSJCTAJOIBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN2/c1-9(2)17-13(10(3)8-16)6-11-4-5-12(15)7-14(11)17/h4-7,9-10H,8,16H2,1-3H3.
What are the key properties of 2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine?
2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine has a molecular weight of 295.22 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine is sourced from PubChem (CID 117122810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).