2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine

C13H23N3 — CID 79352871

IUPAC2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine
SMILESCC(NC1C(C)(C)C1(C)C)c1nccn1C
InChIInChI=1S/C13H23N3/c1-9(10-14-7-8-16(10)6)15-11-12(2,3)13(11,4)5/h7-9,11,15H,1-6H3
InChIKeyHTJPSZGAFYVMCU-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.51
Rot. Bonds3

About 2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine

2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine (PubChem CID 79352871) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine
PubChem CID79352871
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine
SMILESCC(NC1C(C)(C)C1(C)C)c1nccn1C
InChIInChI=1S/C13H23N3/c1-9(10-14-7-8-16(10)6)15-11-12(2,3)13(11,4)5/h7-9,11,15H,1-6H3
InChIKeyHTJPSZGAFYVMCU-UHFFFAOYSA-N
XLogP2.51
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-2-methyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
CID 64923315
[2-[1-(1-methylimidazol-2-yl)ethylamino]cyclohexyl]methanol
CID 103914086
(1R)-1-(1-methylimidazol-2-yl)ethanamine
CID 42220137
N-[(1-cyclopropylcyclopropyl)methyl]-1-(1-methylimidazol-2-yl)ethanamine
CID 115901551
N-[1-(1-methylimidazol-2-yl)ethyl]pent-4-yn-1-amine
CID 103914331
methane;1-(1-methylimidazol-2-yl)ethanol
CID 174578222
(1S)-1-(1-methylimidazol-2-yl)ethanamine;dihydrochloride
CID 162341662
N-(2-ethylsulfonylethyl)-1-(1-methylimidazol-2-yl)ethanamine
CID 103913887
2-methyl-1-[1-(1-methylimidazol-2-yl)ethylamino]propan-2-ol
CID 65104045
(1S)-N-[1-(1-methylimidazol-2-yl)ethyl]-1-(4-methylphenyl)ethanamine
CID 81357198
N-ethyl-3-(1-methylimidazol-2-yl)butan-2-amine
CID 63200047
N-[1-(1-methylimidazol-2-yl)ethyl]pent-4-en-2-amine
CID 115901331

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine (CID 79352871) is 2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine is CC(NC1C(C)(C)C1(C)C)c1nccn1C.
What is the InChIKey of 2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine?
The InChIKey is HTJPSZGAFYVMCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-9(10-14-7-8-16(10)6)15-11-12(2,3)13(11,4)5/h7-9,11,15H,1-6H3.
What are the key properties of 2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine?
2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine has a molecular weight of 221.35 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetramethyl-N-[1-(1-methylimidazol-2-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 79352871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).