4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine

C18H29N7 — CID 119037221

IUPAC4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine
SMILESCCn1ccnc1C1CCCCN1c1nc(C(C)C)nc(N(C)C)n1
InChIInChI=1S/C18H29N7/c1-6-24-12-10-19-16(24)14-9-7-8-11-25(14)18-21-15(13(2)3)20-17(22-18)23(4)5/h10,12-14H,6-9,11H2,1-5H3
InChIKeyHCWXJFYUUAUMKM-UHFFFAOYSA-N
MW343.48 g/mol
LogP3.01
Rot. Bonds5

About 4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine

4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine (PubChem CID 119037221) has the molecular formula C18H29N7 and a molecular weight of 343.48 g/mol. Its IUPAC name is 4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine
PubChem CID119037221
Molecular FormulaC18H29N7
Molecular Weight343.48 g/mol
Exact Mass343.25
IUPAC Name4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine
SMILESCCn1ccnc1C1CCCCN1c1nc(C(C)C)nc(N(C)C)n1
InChIInChI=1S/C18H29N7/c1-6-24-12-10-19-16(24)14-9-7-8-11-25(14)18-21-15(13(2)3)20-17(22-18)23(4)5/h10,12-14H,6-9,11H2,1-5H3
InChIKeyHCWXJFYUUAUMKM-UHFFFAOYSA-N
XLogP3.01
TPSA62.97 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.48
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-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 4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine (CID 119037221) is 4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine is CCn1ccnc1C1CCCCN1c1nc(C(C)C)nc(N(C)C)n1.
What is the InChIKey of 4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine?
The InChIKey is HCWXJFYUUAUMKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N7/c1-6-24-12-10-19-16(24)14-9-7-8-11-25(14)18-21-15(13(2)3)20-17(22-18)23(4)5/h10,12-14H,6-9,11H2,1-5H3.
What are the key properties of 4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine?
4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine has a molecular weight of 343.48 g/mol, XLogP of 3.01, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-ethylimidazol-2-yl)piperidin-1-yl]-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 119037221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).