4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine

C18H24N4 — CID 127050047

IUPAC4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine
SMILESCc1cc(N)nc(CCc2cncc(N3CCCCC3)c2)c1
InChIInChI=1S/C18H24N4/c1-14-9-16(21-18(19)10-14)6-5-15-11-17(13-20-12-15)22-7-3-2-4-8-22/h9-13H,2-8H2,1H3,(H2,19,21)
InChIKeyAKRCKJOKFKEMIF-UHFFFAOYSA-N
MW296.42 g/mol
LogP3.14
Rot. Bonds4

About 4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine

4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine (PubChem CID 127050047) has the molecular formula C18H24N4 and a molecular weight of 296.42 g/mol. Its IUPAC name is 4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine
PubChem CID127050047
Molecular FormulaC18H24N4
Molecular Weight296.42 g/mol
Exact Mass296.20
IUPAC Name4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine
SMILESCc1cc(N)nc(CCc2cncc(N3CCCCC3)c2)c1
InChIInChI=1S/C18H24N4/c1-14-9-16(21-18(19)10-14)6-5-15-11-17(13-20-12-15)22-7-3-2-4-8-22/h9-13H,2-8H2,1H3,(H2,19,21)
InChIKeyAKRCKJOKFKEMIF-UHFFFAOYSA-N
XLogP3.14
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine?
The IUPAC name of 4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine (CID 127050047) is 4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine.
What is the SMILES notation for 4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine?
The canonical SMILES for 4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine is Cc1cc(N)nc(CCc2cncc(N3CCCCC3)c2)c1.
What is the InChIKey of 4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine?
The InChIKey is AKRCKJOKFKEMIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4/c1-14-9-16(21-18(19)10-14)6-5-15-11-17(13-20-12-15)22-7-3-2-4-8-22/h9-13H,2-8H2,1H3,(H2,19,21).
What are the key properties of 4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine?
4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine has a molecular weight of 296.42 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-[2-(5-piperidin-1-yl-3-pyridinyl)ethyl]pyridin-2-amine is sourced from PubChem (CID 127050047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).