N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine

C14H17N5 — CID 47054044

IUPACN-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine
SMILESc1ccc(NC2CCN(c3ncccn3)CC2)nc1
InChIInChI=1S/C14H17N5/c1-2-7-15-13(4-1)18-12-5-10-19(11-6-12)14-16-8-3-9-17-14/h1-4,7-9,12H,5-6,10-11H2,(H,15,18)
InChIKeyOMNHGHGCWNKIEI-UHFFFAOYSA-N
MW255.33 g/mol
LogP1.95
Rot. Bonds3

About N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine

N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine (PubChem CID 47054044) has the molecular formula C14H17N5 and a molecular weight of 255.33 g/mol. Its IUPAC name is N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine
PubChem CID47054044
Molecular FormulaC14H17N5
Molecular Weight255.33 g/mol
Exact Mass255.15
IUPAC NameN-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine
SMILESc1ccc(NC2CCN(c3ncccn3)CC2)nc1
InChIInChI=1S/C14H17N5/c1-2-7-15-13(4-1)18-12-5-10-19(11-6-12)14-16-8-3-9-17-14/h1-4,7-9,12H,5-6,10-11H2,(H,15,18)
InChIKeyOMNHGHGCWNKIEI-UHFFFAOYSA-N
XLogP1.95
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.33
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine?
The IUPAC name of N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine (CID 47054044) is N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine.
What is the SMILES notation for N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine?
The canonical SMILES for N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine is c1ccc(NC2CCN(c3ncccn3)CC2)nc1.
What is the InChIKey of N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine?
The InChIKey is OMNHGHGCWNKIEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5/c1-2-7-15-13(4-1)18-12-5-10-19(11-6-12)14-16-8-3-9-17-14/h1-4,7-9,12H,5-6,10-11H2,(H,15,18).
What are the key properties of N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine?
N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine has a molecular weight of 255.33 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine is sourced from PubChem (CID 47054044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).