N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine

C13H19N3 — CID 145392617

IUPACN-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine
SMILESC/C=C\c1ccnc(NC2CCNCC2)c1
InChIInChI=1S/C13H19N3/c1-2-3-11-4-9-15-13(10-11)16-12-5-7-14-8-6-12/h2-4,9-10,12,14H,5-8H2,1H3,(H,15,16)/b3-2-
InChIKeyPACKILRJEUXCBE-IHWYPQMZSA-N
MW217.32 g/mol
LogP2.28
Rot. Bonds3

About N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine

N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine (PubChem CID 145392617) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine.

Molecular Properties

Compound NameN-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine
PubChem CID145392617
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC NameN-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine
SMILESC/C=C\c1ccnc(NC2CCNCC2)c1
InChIInChI=1S/C13H19N3/c1-2-3-11-4-9-15-13(10-11)16-12-5-7-14-8-6-12/h2-4,9-10,12,14H,5-8H2,1H3,(H,15,16)/b3-2-
InChIKeyPACKILRJEUXCBE-IHWYPQMZSA-N
XLogP2.28
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine?
The IUPAC name of N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine (CID 145392617) is N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine.
What is the SMILES notation for N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine?
The canonical SMILES for N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine is C/C=C\c1ccnc(NC2CCNCC2)c1.
What is the InChIKey of N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine?
The InChIKey is PACKILRJEUXCBE-IHWYPQMZSA-N. The full InChI is InChI=1S/C13H19N3/c1-2-3-11-4-9-15-13(10-11)16-12-5-7-14-8-6-12/h2-4,9-10,12,14H,5-8H2,1H3,(H,15,16)/b3-2-.
What are the key properties of N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine?
N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine has a molecular weight of 217.32 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yl-4-[(Z)-prop-1-enyl]pyridin-2-amine is sourced from PubChem (CID 145392617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).