N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine

C17H20N4 — CID 106577448

IUPACN-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine
SMILESCC(C)CNc1nccn1Cc1cccc2cccnc12
InChIInChI=1S/C17H20N4/c1-13(2)11-20-17-19-9-10-21(17)12-15-6-3-5-14-7-4-8-18-16(14)15/h3-10,13H,11-12H2,1-2H3,(H,19,20)
InChIKeyOBBGJHURFLTCHJ-UHFFFAOYSA-N
MW280.38 g/mol
LogP3.55
Rot. Bonds5

About N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine

N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine (PubChem CID 106577448) has the molecular formula C17H20N4 and a molecular weight of 280.38 g/mol. Its IUPAC name is N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine.

Molecular Properties

Compound NameN-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine
PubChem CID106577448
Molecular FormulaC17H20N4
Molecular Weight280.38 g/mol
Exact Mass280.17
IUPAC NameN-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine
SMILESCC(C)CNc1nccn1Cc1cccc2cccnc12
InChIInChI=1S/C17H20N4/c1-13(2)11-20-17-19-9-10-21(17)12-15-6-3-5-14-7-4-8-18-16(14)15/h3-10,13H,11-12H2,1-2H3,(H,19,20)
InChIKeyOBBGJHURFLTCHJ-UHFFFAOYSA-N
XLogP3.55
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-propyl-N-(quinolin-8-ylmethyl)imidazol-2-amine
CID 106577425
1-(naphthalen-1-ylmethyl)-N-propan-2-ylimidazol-2-amine
CID 106571365
2-methyl-N-(quinolin-8-ylmethyl)propan-2-amine
CID 28608485
N-(2-methylpropyl)-1-(2-pyridin-3-ylethyl)imidazol-2-amine
CID 106563117
N-methyl-1-[1-(quinolin-8-ylmethyl)pyrrol-3-yl]ethanamine
CID 79098765
8-[(2,3,4-trimethylpyrrol-1-yl)methyl]quinoline
CID 63926675
1-propan-2-yl-N-(quinolin-8-ylmethyl)pyrazol-4-amine
CID 62902643
8-[(2,5-dimethylpyrrol-1-yl)methyl]quinoline
CID 81423655
1-(2,2-dimethylbutyl)-N-(2-methylpropyl)imidazol-2-amine
CID 106583506
1-(quinolin-8-ylmethyl)pyrrole-2-carbaldehyde
CID 66410307
1-[1-(quinolin-8-ylmethyl)pyrrol-2-yl]butan-2-amine
CID 66405485
1-(2-chloro-3-methylphenyl)-N-(2-methylpropyl)imidazol-2-amine
CID 114250877

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine?
The IUPAC name of N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine (CID 106577448) is N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine.
What is the SMILES notation for N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine?
The canonical SMILES for N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine is CC(C)CNc1nccn1Cc1cccc2cccnc12.
What is the InChIKey of N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine?
The InChIKey is OBBGJHURFLTCHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4/c1-13(2)11-20-17-19-9-10-21(17)12-15-6-3-5-14-7-4-8-18-16(14)15/h3-10,13H,11-12H2,1-2H3,(H,19,20).
What are the key properties of N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine?
N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine has a molecular weight of 280.38 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-1-(quinolin-8-ylmethyl)imidazol-2-amine is sourced from PubChem (CID 106577448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).