6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine

C15H22N4 — CID 55206124

IUPAC6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine
SMILESCn1nccc1Cn1ccc2c1CC(C)(C)CC2N
InChIInChI=1S/C15H22N4/c1-15(2)8-13(16)12-5-7-19(14(12)9-15)10-11-4-6-17-18(11)3/h4-7,13H,8-10,16H2,1-3H3
InChIKeyGUHNZVMEKQBOPD-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.24
Rot. Bonds2

About 6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine

6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine (PubChem CID 55206124) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is 6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine.

Molecular Properties

Compound Name6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine
PubChem CID55206124
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine
SMILESCn1nccc1Cn1ccc2c1CC(C)(C)CC2N
InChIInChI=1S/C15H22N4/c1-15(2)8-13(16)12-5-7-19(14(12)9-15)10-11-4-6-17-18(11)3/h4-7,13H,8-10,16H2,1-3H3
InChIKeyGUHNZVMEKQBOPD-UHFFFAOYSA-N
XLogP2.24
TPSA48.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine?
The IUPAC name of 6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine (CID 55206124) is 6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine.
What is the SMILES notation for 6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine?
The canonical SMILES for 6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine is Cn1nccc1Cn1ccc2c1CC(C)(C)CC2N.
What is the InChIKey of 6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine?
The InChIKey is GUHNZVMEKQBOPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-15(2)8-13(16)12-5-7-19(14(12)9-15)10-11-4-6-17-18(11)3/h4-7,13H,8-10,16H2,1-3H3.
What are the key properties of 6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine?
6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine has a molecular weight of 258.37 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine is sourced from PubChem (CID 55206124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).