7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane

C9H15N3 — CID 144639531

IUPAC7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane
SMILESCC.NC1=CC=C2C=CNC2N1
InChIInChI=1S/C7H9N3.C2H6/c8-6-2-1-5-3-4-9-7(5)10-6;1-2/h1-4,7,9-10H,8H2;1-2H3
InChIKeyONNPKKFZKIUJJC-UHFFFAOYSA-N
MW165.24 g/mol
LogP0.79
Rot. Bonds

About 7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane

7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane (PubChem CID 144639531) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane.

Molecular Properties

Compound Name7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane
PubChem CID144639531
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane
SMILESCC.NC1=CC=C2C=CNC2N1
InChIInChI=1S/C7H9N3.C2H6/c8-6-2-1-5-3-4-9-7(5)10-6;1-2/h1-4,7,9-10H,8H2;1-2H3
InChIKeyONNPKKFZKIUJJC-UHFFFAOYSA-N
XLogP0.79
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 50.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-7,7a-dihydro-1H-pyrrolo[2,3-d]pyrimidin-2-one
CID 138706232
4-amino-1,3,7,7a-tetrahydropyrrolo[2,3-d]pyrimidin-2-one
CID 132647832
2-methyl-1,2-dihydropyridine-3,4-diamine
CID 86341262
1,8a-dihydroquinolin-6-amine;ethane
CID 144947007
6-amino-2-methyl-1,2-dihydropyridine-3-carboxylic acid
CID 86340819
5-bromo-1,8a-dihydrocyclohepta[b]pyrrole
CID 143421690
2-N-methyl-1,2-dihydropyridine-2,6-diamine
CID 86341535
7-sulfanyl-1,7a-dihydropyrrolo[2,3-b]pyridine
CID 89005583
ethyl 4-methyl-7,7a-dihydro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
CID 163462640
3-[4-[(3-aminopiperidin-1-yl)methyl]phenyl]-7,7a-dihydro-1H-pyrrolo[2,3-d]pyrimidin-2-one
CID 123440090
8-methyl-1,2,3,4,4a,5-hexahydropyrido[2,3-b]pyrazine
CID 86340920
1,5,5a,9a-tetrahydro-1,5-benzodiazepine-2-thione
CID 87090551

Frequently Asked Questions

What is the IUPAC name of 7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane?
The IUPAC name of 7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane (CID 144639531) is 7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane.
What is the SMILES notation for 7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane?
The canonical SMILES for 7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane is CC.NC1=CC=C2C=CNC2N1.
What is the InChIKey of 7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane?
The InChIKey is ONNPKKFZKIUJJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3.C2H6/c8-6-2-1-5-3-4-9-7(5)10-6;1-2/h1-4,7,9-10H,8H2;1-2H3.
What are the key properties of 7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane?
7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane has a molecular weight of 165.24 g/mol, XLogP of 0.79, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7a-dihydro-1H-pyrrolo[2,3-b]pyridin-6-amine;ethane is sourced from PubChem (CID 144639531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).