6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine

C13H19N3 — CID 139389752

IUPAC6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine
SMILESNCCCCCCn1ccc2ccncc21
InChIInChI=1S/C13H19N3/c14-7-3-1-2-4-9-16-10-6-12-5-8-15-11-13(12)16/h5-6,8,10-11H,1-4,7,9,14H2
InChIKeyMNVRWQOCTPPYNB-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.56
Rot. Bonds6

About 6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine

6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine (PubChem CID 139389752) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine.

Molecular Properties

Compound Name6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine
PubChem CID139389752
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine
SMILESNCCCCCCn1ccc2ccncc21
InChIInChI=1S/C13H19N3/c14-7-3-1-2-4-9-16-10-6-12-5-8-15-11-13(12)16/h5-6,8,10-11H,1-4,7,9,14H2
InChIKeyMNVRWQOCTPPYNB-UHFFFAOYSA-N
XLogP2.56
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-pyrrolo[2,3-c]pyridin-1-ylpropan-1-ol
CID 117223985
4-(6-bromoindol-1-yl)butan-1-amine
CID 62566051
3-indol-1-ylpropan-1-amine
CID 2512786
1-(3-aminopropyl)indole-6-carboxylic acid
CID 83946639
4-pyrrolo[2,3-b]pyridin-1-ylbutan-1-amine
CID 71778142
methyl 2-[1-(5-aminopentyl)pyrrolo[2,3-c]pyridin-5-yl]pyridine-4-carboxylate
CID 135308320
1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone
CID 92577999
1-oxidopyrrolo[2,3-c]pyridine
CID 87757695
2-amino-3-methyl-1-[4-(3-pyrrolo[2,3-c]pyridin-1-ylpropanoyl)piperazin-1-yl]butan-1-one
CID 110223895
4-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine
CID 18694804
4-(2-methylimidazo[4,5-c]pyridin-1-yl)butan-1-amine
CID 19864517
4-(5,7-dimethylindol-1-yl)butan-1-amine
CID 83968682

Frequently Asked Questions

What is the IUPAC name of 6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine?
The IUPAC name of 6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine (CID 139389752) is 6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine.
What is the SMILES notation for 6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine?
The canonical SMILES for 6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine is NCCCCCCn1ccc2ccncc21.
What is the InChIKey of 6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine?
The InChIKey is MNVRWQOCTPPYNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c14-7-3-1-2-4-9-16-10-6-12-5-8-15-11-13(12)16/h5-6,8,10-11H,1-4,7,9,14H2.
What are the key properties of 6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine?
6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine has a molecular weight of 217.32 g/mol, XLogP of 2.56, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyrrolo[2,3-c]pyridin-1-ylhexan-1-amine is sourced from PubChem (CID 139389752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).