2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine

C18H25N3 — CID 62994598

IUPAC2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine
SMILESCc1ccc(Cn2c(C)cc3c2CC(C)(C)CC3N)cn1
InChIInChI=1S/C18H25N3/c1-12-5-6-14(10-20-12)11-21-13(2)7-15-16(19)8-18(3,4)9-17(15)21/h5-7,10,16H,8-9,11,19H2,1-4H3
InChIKeyQSOWQKFGBRFTNI-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.52
Rot. Bonds2

About 2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine

2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine (PubChem CID 62994598) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine.

Molecular Properties

Compound Name2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine
PubChem CID62994598
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine
SMILESCc1ccc(Cn2c(C)cc3c2CC(C)(C)CC3N)cn1
InChIInChI=1S/C18H25N3/c1-12-5-6-14(10-20-12)11-21-13(2)7-15-16(19)8-18(3,4)9-17(15)21/h5-7,10,16H,8-9,11,19H2,1-4H3
InChIKeyQSOWQKFGBRFTNI-UHFFFAOYSA-N
XLogP3.52
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,6,6-trimethyl-1-(2-methylsulfanylpropyl)-5,7-dihydro-4H-indol-4-amine
CID 113466885
1-(2-cyclopentylethyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-amine
CID 63466449
5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine
CID 62993324
2,6,6-trimethyl-1-piperidin-1-yl-5,7-dihydro-4H-indol-4-amine
CID 83023419
1-(2,6-dimethylpiperidin-1-yl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-amine
CID 83016943
1-(5-fluoro-2-methylphenyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-amine
CID 63466244
1-(2,3-dichlorophenyl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-amine
CID 63465933
1-(2,2-dimethyloxan-4-yl)-2,6,6-trimethyl-5,7-dihydro-4H-indol-4-amine
CID 83035477
2-[4-[(6-methyl-3-pyridinyl)methyl]piperazin-1-yl]ethanamine
CID 134406832
2,6,6-trimethyl-1-[(5-methylpyrazin-2-yl)methyl]-5,7-dihydroindol-4-one
CID 62848113
2-chloro-1-[2,5-dimethyl-1-[(6-methyl-3-pyridinyl)methyl]pyrrol-3-yl]propan-1-one
CID 62990054
3-methyl-1-[(6-methyl-3-pyridinyl)methyl]piperidine-3-carboxylic acid
CID 104823891

Frequently Asked Questions

What is the IUPAC name of 2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine?
The IUPAC name of 2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine (CID 62994598) is 2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine.
What is the SMILES notation for 2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine?
The canonical SMILES for 2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine is Cc1ccc(Cn2c(C)cc3c2CC(C)(C)CC3N)cn1.
What is the InChIKey of 2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine?
The InChIKey is QSOWQKFGBRFTNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-12-5-6-14(10-20-12)11-21-13(2)7-15-16(19)8-18(3,4)9-17(15)21/h5-7,10,16H,8-9,11,19H2,1-4H3.
What are the key properties of 2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine?
2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine has a molecular weight of 283.42 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,6-trimethyl-1-[(6-methyl-3-pyridinyl)methyl]-5,7-dihydro-4H-indol-4-amine is sourced from PubChem (CID 62994598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).