1-tert-butylpyrrolo[2,3-c]pyridin-3-amine

C11H15N3 — CID 169302723

IUPAC1-tert-butylpyrrolo[2,3-c]pyridin-3-amine
SMILESCC(C)(C)n1cc(N)c2ccncc21
InChIInChI=1S/C11H15N3/c1-11(2,3)14-7-9(12)8-4-5-13-6-10(8)14/h4-7H,12H2,1-3H3
InChIKeyCGAFJPUMKQUBLI-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.37
Rot. Bonds

About 1-tert-butylpyrrolo[2,3-c]pyridin-3-amine

1-tert-butylpyrrolo[2,3-c]pyridin-3-amine (PubChem CID 169302723) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 1-tert-butylpyrrolo[2,3-c]pyridin-3-amine.

Molecular Properties

Compound Name1-tert-butylpyrrolo[2,3-c]pyridin-3-amine
PubChem CID169302723
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name1-tert-butylpyrrolo[2,3-c]pyridin-3-amine
SMILESCC(C)(C)n1cc(N)c2ccncc21
InChIInChI=1S/C11H15N3/c1-11(2,3)14-7-9(12)8-4-5-13-6-10(8)14/h4-7H,12H2,1-3H3
InChIKeyCGAFJPUMKQUBLI-UHFFFAOYSA-N
XLogP2.37
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;1-methylpyrrolo[2,3-c]pyridin-3-amine
CID 142426544
1,3-dimethylpyrrolo[2,3-c]pyridine
CID 59430828
3-tert-butyltriazolo[4,5-c]pyridine
CID 59421443
6-tert-butylthieno[2,3-b]pyrrol-4-amine
CID 169302727
isoquinoline-5,8-diamine;hydrochloride
CID 75525603
3-[(5-aminoisoquinolin-8-yl)amino]-2,2-difluoropropan-1-ol
CID 106167568
2,9-phenanthroline-5,6-diamine
CID 118108253
5-methyl-4-(1-methylpyrrolo[2,3-c]pyridin-3-yl)thiophen-2-amine
CID 82386174
4-(2,2-dimethylpropoxy)pyridin-3-amine
CID 97181806
ethane;isoquinolin-5-amine
CID 143675367
9-pyrido[3,4-b]indol-9-ylpyrido[3,4-b]indole
CID 86059681
4-aminopyridine-3-thiol
CID 14062661

Frequently Asked Questions

What is the IUPAC name of 1-tert-butylpyrrolo[2,3-c]pyridin-3-amine?
The IUPAC name of 1-tert-butylpyrrolo[2,3-c]pyridin-3-amine (CID 169302723) is 1-tert-butylpyrrolo[2,3-c]pyridin-3-amine.
What is the SMILES notation for 1-tert-butylpyrrolo[2,3-c]pyridin-3-amine?
The canonical SMILES for 1-tert-butylpyrrolo[2,3-c]pyridin-3-amine is CC(C)(C)n1cc(N)c2ccncc21.
What is the InChIKey of 1-tert-butylpyrrolo[2,3-c]pyridin-3-amine?
The InChIKey is CGAFJPUMKQUBLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-11(2,3)14-7-9(12)8-4-5-13-6-10(8)14/h4-7H,12H2,1-3H3.
What are the key properties of 1-tert-butylpyrrolo[2,3-c]pyridin-3-amine?
1-tert-butylpyrrolo[2,3-c]pyridin-3-amine has a molecular weight of 189.26 g/mol, XLogP of 2.37, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butylpyrrolo[2,3-c]pyridin-3-amine is sourced from PubChem (CID 169302723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).