1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine

C12H16N4 — CID 137369663

IUPAC1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine
SMILESNC1CCN(C2=C3C=CN=C3CN=C2)CC1
InChIInChI=1S/C12H16N4/c13-9-2-5-16(6-3-9)12-8-14-7-11-10(12)1-4-15-11/h1,4,8-9H,2-3,5-7,13H2
InChIKeyMZOZYLOBHZMVAX-UHFFFAOYSA-N
MW216.29 g/mol
LogP0.72
Rot. Bonds1

About 1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine

1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine (PubChem CID 137369663) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine
PubChem CID137369663
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine
SMILESNC1CCN(C2=C3C=CN=C3CN=C2)CC1
InChIInChI=1S/C12H16N4/c13-9-2-5-16(6-3-9)12-8-14-7-11-10(12)1-4-15-11/h1,4,8-9H,2-3,5-7,13H2
InChIKeyMZOZYLOBHZMVAX-UHFFFAOYSA-N
XLogP0.72
TPSA53.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine?
The IUPAC name of 1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine (CID 137369663) is 1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine.
What is the SMILES notation for 1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine?
The canonical SMILES for 1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine is NC1CCN(C2=C3C=CN=C3CN=C2)CC1.
What is the InChIKey of 1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine?
The InChIKey is MZOZYLOBHZMVAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c13-9-2-5-16(6-3-9)12-8-14-7-11-10(12)1-4-15-11/h1,4,8-9H,2-3,5-7,13H2.
What are the key properties of 1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine?
1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine has a molecular weight of 216.29 g/mol, XLogP of 0.72, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7H-pyrrolo[2,3-c]pyridin-4-yl)piperidin-4-amine is sourced from PubChem (CID 137369663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).