4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine

C12H20N4 — CID 143699136

IUPAC4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine
SMILESC/C=C\c1nc(C2(N)CCNCC2)[nH]c1C
InChIInChI=1S/C12H20N4/c1-3-4-10-9(2)15-11(16-10)12(13)5-7-14-8-6-12/h3-4,14H,5-8,13H2,1-2H3,(H,15,16)/b4-3-
InChIKeyPDNKJCYPNRCQKQ-ARJAWSKDSA-N
MW220.32 g/mol
LogP1.29
Rot. Bonds2

About 4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine

4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine (PubChem CID 143699136) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine.

Molecular Properties

Compound Name4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine
PubChem CID143699136
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine
SMILESC/C=C\c1nc(C2(N)CCNCC2)[nH]c1C
InChIInChI=1S/C12H20N4/c1-3-4-10-9(2)15-11(16-10)12(13)5-7-14-8-6-12/h3-4,14H,5-8,13H2,1-2H3,(H,15,16)/b4-3-
InChIKeyPDNKJCYPNRCQKQ-ARJAWSKDSA-N
XLogP1.29
TPSA66.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine?
The IUPAC name of 4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine (CID 143699136) is 4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine.
What is the SMILES notation for 4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine?
The canonical SMILES for 4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine is C/C=C\c1nc(C2(N)CCNCC2)[nH]c1C.
What is the InChIKey of 4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine?
The InChIKey is PDNKJCYPNRCQKQ-ARJAWSKDSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-4-10-9(2)15-11(16-10)12(13)5-7-14-8-6-12/h3-4,14H,5-8,13H2,1-2H3,(H,15,16)/b4-3-.
What are the key properties of 4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine?
4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 1.29, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-methyl-4-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]piperidin-4-amine is sourced from PubChem (CID 143699136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).