N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine

C14H28N4 — CID 62221842

IUPACN-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine
SMILESCCN(CC)CCn1ccnc1CNC(C)(C)C
InChIInChI=1S/C14H28N4/c1-6-17(7-2)10-11-18-9-8-15-13(18)12-16-14(3,4)5/h8-9,16H,6-7,10-12H2,1-5H3
InChIKeyGSYMUZLBWQCDCY-UHFFFAOYSA-N
MW252.41 g/mol
LogP2.11
Rot. Bonds7

About N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine

N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 62221842) has the molecular formula C14H28N4 and a molecular weight of 252.41 g/mol. Its IUPAC name is N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID62221842
Molecular FormulaC14H28N4
Molecular Weight252.41 g/mol
Exact Mass252.23
IUPAC NameN-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine
SMILESCCN(CC)CCn1ccnc1CNC(C)(C)C
InChIInChI=1S/C14H28N4/c1-6-17(7-2)10-11-18-9-8-15-13(18)12-16-14(3,4)5/h8-9,16H,6-7,10-12H2,1-5H3
InChIKeyGSYMUZLBWQCDCY-UHFFFAOYSA-N
XLogP2.11
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.41
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine (CID 62221842) is N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine is CCN(CC)CCn1ccnc1CNC(C)(C)C.
What is the InChIKey of N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is GSYMUZLBWQCDCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4/c1-6-17(7-2)10-11-18-9-8-15-13(18)12-16-14(3,4)5/h8-9,16H,6-7,10-12H2,1-5H3.
What are the key properties of N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine?
N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 252.41 g/mol, XLogP of 2.11, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62221842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).