1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine

C14H27N5 — CID 66599473

IUPAC1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine
SMILESCN(C)Cn1cnc(CN2CCC(N(C)C)CC2)c1
InChIInChI=1S/C14H27N5/c1-16(2)12-19-10-13(15-11-19)9-18-7-5-14(6-8-18)17(3)4/h10-11,14H,5-9,12H2,1-4H3
InChIKeyJOFMEVIPGXEOBX-UHFFFAOYSA-N
MW265.40 g/mol
LogP0.93
Rot. Bonds5

About 1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine

1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine (PubChem CID 66599473) has the molecular formula C14H27N5 and a molecular weight of 265.40 g/mol. Its IUPAC name is 1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine
PubChem CID66599473
Molecular FormulaC14H27N5
Molecular Weight265.40 g/mol
Exact Mass265.23
IUPAC Name1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine
SMILESCN(C)Cn1cnc(CN2CCC(N(C)C)CC2)c1
InChIInChI=1S/C14H27N5/c1-16(2)12-19-10-13(15-11-19)9-18-7-5-14(6-8-18)17(3)4/h10-11,14H,5-9,12H2,1-4H3
InChIKeyJOFMEVIPGXEOBX-UHFFFAOYSA-N
XLogP0.93
TPSA27.54 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine?
The IUPAC name of 1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine (CID 66599473) is 1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine?
The canonical SMILES for 1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine is CN(C)Cn1cnc(CN2CCC(N(C)C)CC2)c1.
What is the InChIKey of 1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine?
The InChIKey is JOFMEVIPGXEOBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N5/c1-16(2)12-19-10-13(15-11-19)9-18-7-5-14(6-8-18)17(3)4/h10-11,14H,5-9,12H2,1-4H3.
What are the key properties of 1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine?
1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine has a molecular weight of 265.40 g/mol, XLogP of 0.93, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[1-[(dimethylamino)methyl]imidazol-4-yl]methyl]-N,N-dimethylpiperidin-4-amine is sourced from PubChem (CID 66599473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).