5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine

C14H20N2 — CID 162439065

IUPAC5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine
SMILESCCC(C)c1cc2cc(C(C)C)[nH]c2cn1
InChIInChI=1S/C14H20N2/c1-5-10(4)13-7-11-6-12(9(2)3)16-14(11)8-15-13/h6-10,16H,5H2,1-4H3
InChIKeyFUAXHLRMZZMQLV-UHFFFAOYSA-N
MW216.33 g/mol
LogP4.20
Rot. Bonds3

About 5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine

5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine (PubChem CID 162439065) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine
PubChem CID162439065
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine
SMILESCCC(C)c1cc2cc(C(C)C)[nH]c2cn1
InChIInChI=1S/C14H20N2/c1-5-10(4)13-7-11-6-12(9(2)3)16-14(11)8-15-13/h6-10,16H,5H2,1-4H3
InChIKeyFUAXHLRMZZMQLV-UHFFFAOYSA-N
XLogP4.20
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(2S)-butan-2-yl]-4,5-dimethylpyridine
CID 163020641
2,5,6-tri(propan-2-yl)-1H-indole
CID 134294534
[5-(2-propan-2-yl-1H-indol-6-yl)pyrazin-2-yl]methanamine
CID 176926250
6-propan-2-yl-2-[2-(1H-pyrrolo[2,3-c]pyridin-2-yl)propyl]-1H-pyrrolo[3,2-c]pyridine
CID 146339122
ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine
CID 171795656
2-bromo-5-butan-2-ylpyrazine
CID 91862993
5-chloro-6-(2-ethoxyethoxy)-2-propan-2-yl-1H-indole
CID 171731898
6-bromo-2-propan-2-yl-1H-pyrrolo[3,2-b]pyridine
CID 123742080
2,6-di(propan-2-yl)-1H-indole
CID 59835911
CID 175620660
CID 175620660
5-[(5-chloro-2-propan-2-yl-1H-indol-6-yl)oxymethyl]-2-methyl-1,3-thiazole
CID 171519213
2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine
CID 20680867

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine (CID 162439065) is 5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine is CCC(C)c1cc2cc(C(C)C)[nH]c2cn1.
What is the InChIKey of 5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine?
The InChIKey is FUAXHLRMZZMQLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-5-10(4)13-7-11-6-12(9(2)3)16-14(11)8-15-13/h6-10,16H,5H2,1-4H3.
What are the key properties of 5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine?
5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine has a molecular weight of 216.33 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 162439065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).