1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine

C14H26N4 — CID 106581922

IUPAC1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine
SMILESCC(C)Nc1nccn1CCC1CCN(C)CC1
InChIInChI=1S/C14H26N4/c1-12(2)16-14-15-7-11-18(14)10-6-13-4-8-17(3)9-5-13/h7,11-13H,4-6,8-10H2,1-3H3,(H,15,16)
InChIKeyCUXFLNKLAZLQHY-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.44
Rot. Bonds5

About 1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine

1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine (PubChem CID 106581922) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine.

Molecular Properties

Compound Name1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine
PubChem CID106581922
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine
SMILESCC(C)Nc1nccn1CCC1CCN(C)CC1
InChIInChI=1S/C14H26N4/c1-12(2)16-14-15-7-11-18(14)10-6-13-4-8-17(3)9-5-13/h7,11-13H,4-6,8-10H2,1-3H3,(H,15,16)
InChIKeyCUXFLNKLAZLQHY-UHFFFAOYSA-N
XLogP2.44
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine?
The IUPAC name of 1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine (CID 106581922) is 1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine.
What is the SMILES notation for 1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine?
The canonical SMILES for 1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine is CC(C)Nc1nccn1CCC1CCN(C)CC1.
What is the InChIKey of 1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine?
The InChIKey is CUXFLNKLAZLQHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-12(2)16-14-15-7-11-18(14)10-6-13-4-8-17(3)9-5-13/h7,11-13H,4-6,8-10H2,1-3H3,(H,15,16).
What are the key properties of 1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine?
1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine has a molecular weight of 250.39 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-methylpiperidin-4-yl)ethyl]-N-propan-2-ylimidazol-2-amine is sourced from PubChem (CID 106581922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).