N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine

C17H19N3 — CID 155412230

IUPACN-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine
SMILESCC(C)(C)c1cccc(Nc2ccc3cc[nH]c3c2)n1
InChIInChI=1S/C17H19N3/c1-17(2,3)15-5-4-6-16(20-15)19-13-8-7-12-9-10-18-14(12)11-13/h4-11,18H,1-3H3,(H,19,20)
InChIKeyXDJHZYXAYURROH-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.60
Rot. Bonds2

About N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine

N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine (PubChem CID 155412230) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine.

Molecular Properties

Compound NameN-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine
PubChem CID155412230
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine
SMILESCC(C)(C)c1cccc(Nc2ccc3cc[nH]c3c2)n1
InChIInChI=1S/C17H19N3/c1-17(2,3)15-5-4-6-16(20-15)19-13-8-7-12-9-10-18-14(12)11-13/h4-11,18H,1-3H3,(H,19,20)
InChIKeyXDJHZYXAYURROH-UHFFFAOYSA-N
XLogP4.60
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[6-[(Z)-but-1-enyl]-2-pyridinyl]-1H-indol-6-amine
CID 155392032
N-pyridin-4-yl-1H-indol-6-amine
CID 19047631
N-[5-(trifluoromethoxy)-2-pyridinyl]-1H-indol-6-amine
CID 155412381
6-(1H-indol-6-ylamino)-4-[3-(trifluoromethyl)phenoxy]pyridine-2-carbonitrile
CID 171850841
3-(1H-indol-6-ylamino)-2-methylbenzonitrile
CID 70020979
N-(3-tert-butylphenyl)-N-[2-(1H-indol-6-ylamino)-3-pyridinyl]formamide
CID 141061892
N-[5-[3-[2-[6-(1H-indol-5-ylamino)-2-pyridinyl]-2-methylpropyl]piperidin-1-yl]sulfonyl-2-pyridinyl]-1H-indol-5-amine
CID 155432681
4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile
CID 175628729
N-(2-chloropyrimidin-4-yl)-1H-indol-5-amine
CID 88557543
N-(4-phenylpyrimidin-2-yl)-1H-indol-6-amine
CID 155412429
N-[5,6-bis(ethenyl)-2-pyridinyl]-1H-indol-5-amine;ethane
CID 171106670
N-(1H-indol-5-yl)-7-propan-2-ylquinolin-2-amine
CID 171106526

Frequently Asked Questions

What is the IUPAC name of N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine?
The IUPAC name of N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine (CID 155412230) is N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine.
What is the SMILES notation for N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine?
The canonical SMILES for N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine is CC(C)(C)c1cccc(Nc2ccc3cc[nH]c3c2)n1.
What is the InChIKey of N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine?
The InChIKey is XDJHZYXAYURROH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-17(2,3)15-5-4-6-16(20-15)19-13-8-7-12-9-10-18-14(12)11-13/h4-11,18H,1-3H3,(H,19,20).
What are the key properties of N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine?
N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine has a molecular weight of 265.36 g/mol, XLogP of 4.60, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine is sourced from PubChem (CID 155412230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).