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

C17H28N2 — CID 107415147

IUPAC6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine
SMILESCC1CCC(Cn2ccc3c2CC(C)(C)CC3N)C1
InChIInChI=1S/C17H28N2/c1-12-4-5-13(8-12)11-19-7-6-14-15(18)9-17(2,3)10-16(14)19/h6-7,12-13,15H,4-5,8-11,18H2,1-3H3
InChIKeyAPPAHPAVKBGBRO-UHFFFAOYSA-N
MW260.42 g/mol
LogP3.90
Rot. Bonds2

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

6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine (PubChem CID 107415147) has the molecular formula C17H28N2 and a molecular weight of 260.42 g/mol. Its IUPAC name is 6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine.

Molecular Properties

Compound Name6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine
PubChem CID107415147
Molecular FormulaC17H28N2
Molecular Weight260.42 g/mol
Exact Mass260.23
IUPAC Name6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine
SMILESCC1CCC(Cn2ccc3c2CC(C)(C)CC3N)C1
InChIInChI=1S/C17H28N2/c1-12-4-5-13(8-12)11-19-7-6-14-15(18)9-17(2,3)10-16(14)19/h6-7,12-13,15H,4-5,8-11,18H2,1-3H3
InChIKeyAPPAHPAVKBGBRO-UHFFFAOYSA-N
XLogP3.90
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.42
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine?
The IUPAC name of 6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine (CID 107415147) is 6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine.
What is the SMILES notation for 6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine?
The canonical SMILES for 6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine is CC1CCC(Cn2ccc3c2CC(C)(C)CC3N)C1.
What is the InChIKey of 6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine?
The InChIKey is APPAHPAVKBGBRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-12-4-5-13(8-12)11-19-7-6-14-15(18)9-17(2,3)10-16(14)19/h6-7,12-13,15H,4-5,8-11,18H2,1-3H3.
What are the key properties of 6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine?
6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine has a molecular weight of 260.42 g/mol, XLogP of 3.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine is sourced from PubChem (CID 107415147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).