3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine

C15H22N2 — CID 117205192

IUPAC3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine
SMILESCc1cc2cccc(CCCN)c2n1C(C)C
InChIInChI=1S/C15H22N2/c1-11(2)17-12(3)10-14-7-4-6-13(15(14)17)8-5-9-16/h4,6-7,10-11H,5,8-9,16H2,1-3H3
InChIKeyGVBFJHYZEJHNBB-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.42
Rot. Bonds4

About 3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine

3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine (PubChem CID 117205192) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine.

Molecular Properties

Compound Name3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine
PubChem CID117205192
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine
SMILESCc1cc2cccc(CCCN)c2n1C(C)C
InChIInChI=1S/C15H22N2/c1-11(2)17-12(3)10-14-7-4-6-13(15(14)17)8-5-9-16/h4,6-7,10-11H,5,8-9,16H2,1-3H3
InChIKeyGVBFJHYZEJHNBB-UHFFFAOYSA-N
XLogP3.42
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-bromo-2-methyl-1-propan-2-ylindole
CID 68911786
3-(2-methyl-1-propan-2-ylindol-6-yl)propan-1-amine
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3-(2-chloro-3-methylphenyl)propan-1-amine
CID 83696792
3-(2-propan-2-yl-3,4-dihydro-1H-isoquinolin-8-yl)propan-1-amine
CID 84795685
3-(2-fluoro-3-methylphenyl)propan-1-amine
CID 70348406
3-(7-bromo-1-ethylindol-2-yl)propan-1-amine
CID 117196972
3-(7-propylnaphthalen-1-yl)propan-1-amine
CID 19086002
N-[[7-(aminomethyl)-1-propan-2-ylindol-2-yl]methyl]cyclobutanamine
CID 117183919
2-(aminomethyl)-1-propan-2-ylindole-7-carboxylic acid
CID 117184356
3-(4-fluoro-1-propan-2-ylbenzimidazol-2-yl)propan-1-amine
CID 60785241
3-(4-chloro-1-propan-2-ylindol-2-yl)propan-1-amine
CID 117120480
3-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)propan-1-amine
CID 54919824

Frequently Asked Questions

What is the IUPAC name of 3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine?
The IUPAC name of 3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine (CID 117205192) is 3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine.
What is the SMILES notation for 3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine?
The canonical SMILES for 3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine is Cc1cc2cccc(CCCN)c2n1C(C)C.
What is the InChIKey of 3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine?
The InChIKey is GVBFJHYZEJHNBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-11(2)17-12(3)10-14-7-4-6-13(15(14)17)8-5-9-16/h4,6-7,10-11H,5,8-9,16H2,1-3H3.
What are the key properties of 3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine?
3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine has a molecular weight of 230.35 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyl-1-propan-2-ylindol-7-yl)propan-1-amine is sourced from PubChem (CID 117205192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).