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

C10H13N3 — CID 66414119

IUPAC(1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine
SMILESCCn1cc(CN)c2cccnc21
InChIInChI=1S/C10H13N3/c1-2-13-7-8(6-11)9-4-3-5-12-10(9)13/h3-5,7H,2,6,11H2,1H3
InChIKeyWRRFCPOKLVYFHS-UHFFFAOYSA-N
MW175.24 g/mol
LogP1.51
Rot. Bonds2

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

(1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine (PubChem CID 66414119) has the molecular formula C10H13N3 and a molecular weight of 175.24 g/mol. Its IUPAC name is (1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine.

Molecular Properties

Compound Name(1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine
PubChem CID66414119
Molecular FormulaC10H13N3
Molecular Weight175.24 g/mol
Exact Mass175.11
IUPAC Name(1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine
SMILESCCn1cc(CN)c2cccnc21
InChIInChI=1S/C10H13N3/c1-2-13-7-8(6-11)9-4-3-5-12-10(9)13/h3-5,7H,2,6,11H2,1H3
InChIKeyWRRFCPOKLVYFHS-UHFFFAOYSA-N
XLogP1.51
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.24
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-pentylpyrrolo[2,3-b]pyridin-3-yl)methanamine
CID 66415692
[1-(2-ethoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]methanamine
CID 66414725
2-[3-(aminomethyl)pyrrolo[2,3-b]pyridin-1-yl]-N-ethylacetamide
CID 66414520
N-[(1-ethylpyrrolo[2,3-b]pyridin-3-yl)methyl]propan-2-amine
CID 66412207
[1-(2-pyridin-2-ylethyl)pyrrolo[2,3-b]pyridin-3-yl]methanamine
CID 66416272
[1-[(1-methylimidazol-2-yl)methyl]pyrrolo[2,3-b]pyridin-3-yl]methanamine
CID 66416482
butyl 2-[3-(aminomethyl)pyrrolo[2,3-b]pyridin-1-yl]acetate
CID 66415107
2-[3-(aminomethyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(cyanomethyl)acetamide
CID 66413943
2-[3-(aminomethyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-methylpropyl)acetamide
CID 66416278
[1-(thiophen-2-ylmethyl)pyrrolo[2,3-b]pyridin-3-yl]methanamine
CID 66414124
[1-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrrolo[2,3-b]pyridin-3-yl]methanamine
CID 66413936
2-[3-(aminomethyl)pyrrolo[2,3-b]pyridin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 66414126

Frequently Asked Questions

What is the IUPAC name of (1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine?
The IUPAC name of (1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine (CID 66414119) is (1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine.
What is the SMILES notation for (1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine?
The canonical SMILES for (1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine is CCn1cc(CN)c2cccnc21.
What is the InChIKey of (1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine?
The InChIKey is WRRFCPOKLVYFHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-2-13-7-8(6-11)9-4-3-5-12-10(9)13/h3-5,7H,2,6,11H2,1H3.
What are the key properties of (1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine?
(1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine has a molecular weight of 175.24 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine is sourced from PubChem (CID 66414119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).