2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine

C10H13N3 — CID 20680867

IUPAC2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine
SMILESCC(C)c1cc2c(N)nccc2[nH]1
InChIInChI=1S/C10H13N3/c1-6(2)9-5-7-8(13-9)3-4-12-10(7)11/h3-6,13H,1-2H3,(H2,11,12)
InChIKeyVGGIRWQEVWVJOK-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.27
Rot. Bonds1

About 2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine

2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine (PubChem CID 20680867) has the molecular formula C10H13N3 and a molecular weight of 175.23 g/mol. Its IUPAC name is 2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine.

Molecular Properties

Compound Name2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine
PubChem CID20680867
Molecular FormulaC10H13N3
Molecular Weight175.23 g/mol
Exact Mass175.11
IUPAC Name2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine
SMILESCC(C)c1cc2c(N)nccc2[nH]1
InChIInChI=1S/C10H13N3/c1-6(2)9-5-7-8(13-9)3-4-12-10(7)11/h3-6,13H,1-2H3,(H2,11,12)
InChIKeyVGGIRWQEVWVJOK-UHFFFAOYSA-N
XLogP2.27
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine?
The IUPAC name of 2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine (CID 20680867) is 2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine.
What is the SMILES notation for 2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine?
The canonical SMILES for 2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine is CC(C)c1cc2c(N)nccc2[nH]1.
What is the InChIKey of 2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine?
The InChIKey is VGGIRWQEVWVJOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-6(2)9-5-7-8(13-9)3-4-12-10(7)11/h3-6,13H,1-2H3,(H2,11,12).
What are the key properties of 2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine?
2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine has a molecular weight of 175.23 g/mol, XLogP of 2.27, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine is sourced from PubChem (CID 20680867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).