N-tert-butyl-1-butylimidazol-2-amine

C11H21N3 — CID 106554804

IUPACN-tert-butyl-1-butylimidazol-2-amine
SMILESCCCCn1ccnc1NC(C)(C)C
InChIInChI=1S/C11H21N3/c1-5-6-8-14-9-7-12-10(14)13-11(2,3)4/h7,9H,5-6,8H2,1-4H3,(H,12,13)
InChIKeyOZZBCRIKYVCBKH-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.89
Rot. Bonds4

About N-tert-butyl-1-butylimidazol-2-amine

N-tert-butyl-1-butylimidazol-2-amine (PubChem CID 106554804) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is N-tert-butyl-1-butylimidazol-2-amine.

Molecular Properties

Compound NameN-tert-butyl-1-butylimidazol-2-amine
PubChem CID106554804
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC NameN-tert-butyl-1-butylimidazol-2-amine
SMILESCCCCn1ccnc1NC(C)(C)C
InChIInChI=1S/C11H21N3/c1-5-6-8-14-9-7-12-10(14)13-11(2,3)4/h7,9H,5-6,8H2,1-4H3,(H,12,13)
InChIKeyOZZBCRIKYVCBKH-UHFFFAOYSA-N
XLogP2.89
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-butyl-N-(3,3-dimethylbutan-2-yl)imidazol-2-amine
CID 106580868
1-dodecyl-N-methylimidazol-2-amine
CID 57016020
N-butyl-1-hexylimidazol-2-amine
CID 106573794
1-butyl-N-(2-methylbutyl)imidazol-2-amine
CID 106570370
1-butyl-N-(2-pyrazol-1-ylethyl)imidazol-2-amine
CID 106568584
1-butyl-N-(2-ethoxyethyl)imidazol-2-amine
CID 106554086
N-hexyl-1-propylimidazol-2-amine
CID 106573792
1-pentyl-N-propan-2-ylimidazol-2-amine
CID 106556908
1-(3-ethoxypropyl)-N-(2-methylbutan-2-yl)imidazol-2-amine
CID 106554767
1-butyl-N-(3-methylpentan-2-yl)imidazol-2-amine
CID 106564650
N-cyclopropyl-1-pentylimidazol-2-amine
CID 106556933
1-butyl-2-iodoimidazole
CID 69317070

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-1-butylimidazol-2-amine?
The IUPAC name of N-tert-butyl-1-butylimidazol-2-amine (CID 106554804) is N-tert-butyl-1-butylimidazol-2-amine.
What is the SMILES notation for N-tert-butyl-1-butylimidazol-2-amine?
The canonical SMILES for N-tert-butyl-1-butylimidazol-2-amine is CCCCn1ccnc1NC(C)(C)C.
What is the InChIKey of N-tert-butyl-1-butylimidazol-2-amine?
The InChIKey is OZZBCRIKYVCBKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-5-6-8-14-9-7-12-10(14)13-11(2,3)4/h7,9H,5-6,8H2,1-4H3,(H,12,13).
What are the key properties of N-tert-butyl-1-butylimidazol-2-amine?
N-tert-butyl-1-butylimidazol-2-amine has a molecular weight of 195.31 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-1-butylimidazol-2-amine is sourced from PubChem (CID 106554804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).