4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine

C13H24N4 — CID 106553053

IUPAC4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine
SMILESCCc1cn(C)c(N(C)CC2CCNCC2)n1
InChIInChI=1S/C13H24N4/c1-4-12-10-17(3)13(15-12)16(2)9-11-5-7-14-8-6-11/h10-11,14H,4-9H2,1-3H3
InChIKeyJQJIMONAMIWVPV-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.42
Rot. Bonds4

About 4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine

4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine (PubChem CID 106553053) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is 4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine.

Molecular Properties

Compound Name4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine
PubChem CID106553053
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC Name4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine
SMILESCCc1cn(C)c(N(C)CC2CCNCC2)n1
InChIInChI=1S/C13H24N4/c1-4-12-10-17(3)13(15-12)16(2)9-11-5-7-14-8-6-11/h10-11,14H,4-9H2,1-3H3
InChIKeyJQJIMONAMIWVPV-UHFFFAOYSA-N
XLogP1.42
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine?
The IUPAC name of 4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine (CID 106553053) is 4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine.
What is the SMILES notation for 4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine?
The canonical SMILES for 4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine is CCc1cn(C)c(N(C)CC2CCNCC2)n1.
What is the InChIKey of 4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine?
The InChIKey is JQJIMONAMIWVPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-4-12-10-17(3)13(15-12)16(2)9-11-5-7-14-8-6-11/h10-11,14H,4-9H2,1-3H3.
What are the key properties of 4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine?
4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine has a molecular weight of 236.36 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N,1-dimethyl-N-(piperidin-4-ylmethyl)imidazol-2-amine is sourced from PubChem (CID 106553053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).