(2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine

C12H15N3 — CID 84670204

IUPAC(2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine
SMILESCn1c(C2CC2)c(CN)c2cccnc21
InChIInChI=1S/C12H15N3/c1-15-11(8-4-5-8)10(7-13)9-3-2-6-14-12(9)15/h2-3,6,8H,4-5,7,13H2,1H3
InChIKeyGRPXWXQULYCVMO-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.91
Rot. Bonds2

About (2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine

(2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine (PubChem CID 84670204) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is (2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine.

Molecular Properties

Compound Name(2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine
PubChem CID84670204
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name(2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine
SMILESCn1c(C2CC2)c(CN)c2cccnc21
InChIInChI=1S/C12H15N3/c1-15-11(8-4-5-8)10(7-13)9-3-2-6-14-12(9)15/h2-3,6,8H,4-5,7,13H2,1H3
InChIKeyGRPXWXQULYCVMO-UHFFFAOYSA-N
XLogP1.91
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-cyclopentyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine
CID 84692905
2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridine-3-carboxylic acid
CID 84681728
(1-methyl-2-propan-2-ylpyrrolo[2,3-b]pyridin-3-yl)methanamine
CID 84671774
2-[2-cyclopropyl-3-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyrrolo[2,3-b]pyridin-1-yl]-N,N-dimethylacetamide
CID 92605893
1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine
CID 82415409
9-methylpyrido[2,3-b]indole
CID 12596580
ethane;9-methylpyrido[2,3-b]indole;propane
CID 171072564
(1S)-2-amino-1-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethanol
CID 96855329
1-methyl-3-piperidin-4-ylpyrazolo[3,4-b]pyridine
CID 66509747
(1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine
CID 66414119
3-chloro-1-methyl-2-phenylpyrrolo[2,3-b]pyridine
CID 146162317
(4-hydroxy-1-methyl-2-oxo-1,8-naphthyridin-3-yl)-phenyliodanium
CID 87903535

Frequently Asked Questions

What is the IUPAC name of (2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine?
The IUPAC name of (2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine (CID 84670204) is (2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine.
What is the SMILES notation for (2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine?
The canonical SMILES for (2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine is Cn1c(C2CC2)c(CN)c2cccnc21.
What is the InChIKey of (2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine?
The InChIKey is GRPXWXQULYCVMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-15-11(8-4-5-8)10(7-13)9-3-2-6-14-12(9)15/h2-3,6,8H,4-5,7,13H2,1H3.
What are the key properties of (2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine?
(2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine has a molecular weight of 201.27 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine is sourced from PubChem (CID 84670204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).