N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine

C11H20N4 — CID 63109350

IUPACN-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine
SMILESCCN(Cc1cnc[nH]1)C1CCNCC1
InChIInChI=1S/C11H20N4/c1-2-15(8-10-7-13-9-14-10)11-3-5-12-6-4-11/h7,9,11-12H,2-6,8H2,1H3,(H,13,14)
InChIKeySGWMNFSXTIOSBO-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.98
Rot. Bonds4

About N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine

N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine (PubChem CID 63109350) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine
PubChem CID63109350
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC NameN-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine
SMILESCCN(Cc1cnc[nH]1)C1CCNCC1
InChIInChI=1S/C11H20N4/c1-2-15(8-10-7-13-9-14-10)11-3-5-12-6-4-11/h7,9,11-12H,2-6,8H2,1H3,(H,13,14)
InChIKeySGWMNFSXTIOSBO-UHFFFAOYSA-N
XLogP0.98
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine?
The IUPAC name of N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine (CID 63109350) is N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine.
What is the SMILES notation for N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine?
The canonical SMILES for N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine is CCN(Cc1cnc[nH]1)C1CCNCC1.
What is the InChIKey of N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine?
The InChIKey is SGWMNFSXTIOSBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-2-15(8-10-7-13-9-14-10)11-3-5-12-6-4-11/h7,9,11-12H,2-6,8H2,1H3,(H,13,14).
What are the key properties of N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine?
N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine has a molecular weight of 208.31 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(1H-imidazol-5-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 63109350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).