1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide

C15H21IN4 — CID 120971198

IUPAC1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide
SMILESCc1cccc2c(CCNC3=NCCN3C)c[nH]c12.I
InChIInChI=1S/C15H20N4.HI/c1-11-4-3-5-13-12(10-18-14(11)13)6-7-16-15-17-8-9-19(15)2;/h3-5,10,18H,6-9H2,1-2H3,(H,16,17);1H
InChIKeyZQSXHRJVANTIAC-UHFFFAOYSA-N
MW384.27 g/mol
LogP2.53
Rot. Bonds3

About 1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide

1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide (PubChem CID 120971198) has the molecular formula C15H21IN4 and a molecular weight of 384.27 g/mol. Its IUPAC name is 1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide.

Molecular Properties

Compound Name1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide
PubChem CID120971198
Molecular FormulaC15H21IN4
Molecular Weight384.27 g/mol
Exact Mass384.08
IUPAC Name1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide
SMILESCc1cccc2c(CCNC3=NCCN3C)c[nH]c12.I
InChIInChI=1S/C15H20N4.HI/c1-11-4-3-5-13-12(10-18-14(11)13)6-7-16-15-17-8-9-19(15)2;/h3-5,10,18H,6-9H2,1-2H3,(H,16,17);1H
InChIKeyZQSXHRJVANTIAC-UHFFFAOYSA-N
XLogP2.53
TPSA43.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.27
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]aniline
CID 143759207
2-methyl-1-N-[2-(7-methyl-1H-indol-3-yl)ethyl]benzene-1,4-diamine
CID 59493253
1-methyl-N-(2-pyridin-4-ylethyl)-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120971012
ethane;2-methyl-1-N-[2-(7-methyl-1H-indol-3-yl)ethyl]benzene-1,4-diamine
CID 143759213
2-(7-methyl-1H-indol-3-yl)ethanamine chloride
CID 53351005
N'-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carboximidamide;hydroiodide
CID 109444138
N-[2-(6-fluoro-1-methylindol-3-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120972220
7-methyl-3-(2-phenylethyl)-1H-indole
CID 174735389
2-[3,5-dimethyl-4-[[2-(7-methyl-1H-indol-3-yl)ethylamino]methyl]pyrazol-1-yl]ethanol
CID 111467749
(2R)-1-(3,5-dimethylpyrazol-1-yl)-N-[2-(7-methyl-1H-indol-3-yl)ethyl]propan-2-amine
CID 95200660
1-[2-(7-methyl-1H-indol-3-yl)ethyl]-2-propylguanidine;hydroiodide
CID 111808945
5-[2-(7-methyl-1H-indol-3-yl)ethylcarbamoyl]furan-2-carboxylic acid
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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide?
The IUPAC name of 1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide (CID 120971198) is 1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide.
What is the SMILES notation for 1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide?
The canonical SMILES for 1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide is Cc1cccc2c(CCNC3=NCCN3C)c[nH]c12.I.
What is the InChIKey of 1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide?
The InChIKey is ZQSXHRJVANTIAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4.HI/c1-11-4-3-5-13-12(10-18-14(11)13)6-7-16-15-17-8-9-19(15)2;/h3-5,10,18H,6-9H2,1-2H3,(H,16,17);1H.
What are the key properties of 1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide?
1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide has a molecular weight of 384.27 g/mol, XLogP of 2.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide is sourced from PubChem (CID 120971198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).