1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine

C13H26N4 — CID 106567764

IUPAC1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine
SMILESCC(C)CNc1nccn1C(C)CCN(C)C
InChIInChI=1S/C13H26N4/c1-11(2)10-15-13-14-7-9-17(13)12(3)6-8-16(4)5/h7,9,11-12H,6,8,10H2,1-5H3,(H,14,15)
InChIKeyYPKBSZTUCAEOQA-UHFFFAOYSA-N
MW238.38 g/mol
LogP2.46
Rot. Bonds7

About 1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine

1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine (PubChem CID 106567764) has the molecular formula C13H26N4 and a molecular weight of 238.38 g/mol. Its IUPAC name is 1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine.

Molecular Properties

Compound Name1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine
PubChem CID106567764
Molecular FormulaC13H26N4
Molecular Weight238.38 g/mol
Exact Mass238.22
IUPAC Name1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine
SMILESCC(C)CNc1nccn1C(C)CCN(C)C
InChIInChI=1S/C13H26N4/c1-11(2)10-15-13-14-7-9-17(13)12(3)6-8-16(4)5/h7,9,11-12H,6,8,10H2,1-5H3,(H,14,15)
InChIKeyYPKBSZTUCAEOQA-UHFFFAOYSA-N
XLogP2.46
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.38
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylpropyl)-1-pentan-2-ylimidazol-2-amine
CID 106555846
1-[4-(dimethylamino)butan-2-yl]-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106567753
N-(2-methylpropyl)-1-(1-phenylpropan-2-yl)imidazol-2-amine
CID 106571877
N-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-2-amine
CID 106567606
1-[1-(dimethylamino)propan-2-yl]-N-ethylimidazol-2-amine
CID 106578657
1-pentan-2-yl-N-propan-2-ylimidazol-2-amine
CID 106555812
1-[1-(diethylamino)propan-2-yl]-N-ethylimidazol-2-amine
CID 106566350
3-N-(1-ethylimidazol-2-yl)-1-N,1-N-dimethylbutane-1,3-diamine
CID 62139161
1-[4-(dimethylamino)butan-2-yl]-N-ethyl-4-methylimidazol-2-amine
CID 106567736
N-methyl-1-octan-2-ylimidazol-2-amine
CID 106564926
N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106581219
N-(2-methylpropyl)-1-(2,2,3,3-tetramethylcyclopropyl)imidazol-2-amine
CID 106576766

Frequently Asked Questions

What is the IUPAC name of 1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine?
The IUPAC name of 1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine (CID 106567764) is 1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine.
What is the SMILES notation for 1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine?
The canonical SMILES for 1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine is CC(C)CNc1nccn1C(C)CCN(C)C.
What is the InChIKey of 1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine?
The InChIKey is YPKBSZTUCAEOQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4/c1-11(2)10-15-13-14-7-9-17(13)12(3)6-8-16(4)5/h7,9,11-12H,6,8,10H2,1-5H3,(H,14,15).
What are the key properties of 1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine?
1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine has a molecular weight of 238.38 g/mol, XLogP of 2.46, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(dimethylamino)butan-2-yl]-N-(2-methylpropyl)imidazol-2-amine is sourced from PubChem (CID 106567764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).