3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine

C12H18N2 — CID 117203805

IUPAC3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine
SMILESCC1CNc2cc(CCCN)ccc21
InChIInChI=1S/C12H18N2/c1-9-8-14-12-7-10(3-2-6-13)4-5-11(9)12/h4-5,7,9,14H,2-3,6,8,13H2,1H3
InChIKeyHCWDBZVUFJLULS-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.11
Rot. Bonds3

About 3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine

3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine (PubChem CID 117203805) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine.

Molecular Properties

Compound Name3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine
PubChem CID117203805
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine
SMILESCC1CNc2cc(CCCN)ccc21
InChIInChI=1S/C12H18N2/c1-9-8-14-12-7-10(3-2-6-13)4-5-11(9)12/h4-5,7,9,14H,2-3,6,8,13H2,1H3
InChIKeyHCWDBZVUFJLULS-UHFFFAOYSA-N
XLogP2.11
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-ethyl-3-methyl-2,3-dihydro-1H-indole
CID 88995229
N-methyl-1-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-2-amine
CID 117203789
3-(3-methyl-1,1-dioxo-2,3-dihydro-1-benzothiophen-6-yl)propan-1-amine
CID 117203801
3-(2,3-dihydro-1H-indol-6-yl)propan-1-amine
CID 115105426
3-(1-ethyl-3-methyl-2,3-dihydroindol-6-yl)propan-1-amine
CID 117203809
3-(3-methyl-2,3-dihydro-1-benzothiophen-5-yl)propan-1-amine
CID 117203449
5-(3-aminopropyl)-3-methyl-1,3-dihydroindol-2-one
CID 82190449
(3R)-3-methyl-5-(2-pyrimidin-5-ylethyl)-2,3-dihydro-1H-indole
CID 118411289
6-(3-chloropropyl)-3-methyl-1,2,3,4-tetrahydroquinoline
CID 141087236
3-(3,4-dimethoxyphenyl)propan-1-amine
CID 2281053
3-[4-(3-aminopropyl)phenyl]propan-1-amine;dihydrochloride
CID 22743257
3-(3-methylphenyl)propan-1-amine
CID 12666388

Frequently Asked Questions

What is the IUPAC name of 3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine?
The IUPAC name of 3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine (CID 117203805) is 3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine.
What is the SMILES notation for 3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine?
The canonical SMILES for 3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine is CC1CNc2cc(CCCN)ccc21.
What is the InChIKey of 3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine?
The InChIKey is HCWDBZVUFJLULS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-9-8-14-12-7-10(3-2-6-13)4-5-11(9)12/h4-5,7,9,14H,2-3,6,8,13H2,1H3.
What are the key properties of 3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine?
3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine has a molecular weight of 190.29 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methyl-2,3-dihydro-1H-indol-6-yl)propan-1-amine is sourced from PubChem (CID 117203805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).