N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine

C9H11N3 — CID 141065993

IUPACN-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine
SMILESCCNc1c[nH]c2ncccc12
InChIInChI=1S/C9H11N3/c1-2-10-8-6-12-9-7(8)4-3-5-11-9/h3-6,10H,2H2,1H3,(H,11,12)
InChIKeyNQLWUQOSRDFROK-UHFFFAOYSA-N
MW161.21 g/mol
LogP1.99
Rot. Bonds2

About N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine

N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine (PubChem CID 141065993) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine.

Molecular Properties

Compound NameN-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine
PubChem CID141065993
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC NameN-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine
SMILESCCNc1c[nH]c2ncccc12
InChIInChI=1S/C9H11N3/c1-2-10-8-6-12-9-7(8)4-3-5-11-9/h3-6,10H,2H2,1H3,(H,11,12)
InChIKeyNQLWUQOSRDFROK-UHFFFAOYSA-N
XLogP1.99
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl N-(1H-pyrrolo[2,3-b]pyridin-3-yl)carbamate
CID 141399754
3-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-1H-pyrrolo[2,3-b]pyridine
CID 12037446
N-(1H-pyrrolo[2,3-b]pyridin-3-ylamino)formamide
CID 174976610
ethane;1H-pyrrolo[2,3-b]pyridin-3-amine
CID 142426313
2,2-dimethyl-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)butan-1-one
CID 62678587
N-(4-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-amine
CID 58087153
3-fluoro-1H-pyrrolo[2,3-b]pyridine
CID 20784528
bis(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 151992527
3-(trideuteriomethyl)-1H-pyrrolo[2,3-b]pyridine
CID 101366417
(1R)-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)butan-1-amine
CID 131140420
N-[1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]propan-1-amine
CID 115704290
6-N-ethylquinoline-5,6-diamine
CID 43809532

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine?
The IUPAC name of N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine (CID 141065993) is N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine.
What is the SMILES notation for N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine?
The canonical SMILES for N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine is CCNc1c[nH]c2ncccc12.
What is the InChIKey of N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine?
The InChIKey is NQLWUQOSRDFROK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3/c1-2-10-8-6-12-9-7(8)4-3-5-11-9/h3-6,10H,2H2,1H3,(H,11,12).
What are the key properties of N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine?
N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine has a molecular weight of 161.21 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1H-pyrrolo[2,3-b]pyridin-3-amine is sourced from PubChem (CID 141065993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).