N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine

C17H26N4 — CID 106555586

IUPACN-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
SMILESCC(C)N(CCNc1nccn1-c1ccccc1)C(C)C
InChIInChI=1S/C17H26N4/c1-14(2)20(15(3)4)12-10-18-17-19-11-13-21(17)16-8-6-5-7-9-16/h5-9,11,13-15H,10,12H2,1-4H3,(H,18,19)
InChIKeyJMJVPJUBYHTNJW-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.40
Rot. Bonds7

About N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine

N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine (PubChem CID 106555586) has the molecular formula C17H26N4 and a molecular weight of 286.42 g/mol. Its IUPAC name is N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
PubChem CID106555586
Molecular FormulaC17H26N4
Molecular Weight286.42 g/mol
Exact Mass286.22
IUPAC NameN-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
SMILESCC(C)N(CCNc1nccn1-c1ccccc1)C(C)C
InChIInChI=1S/C17H26N4/c1-14(2)20(15(3)4)12-10-18-17-19-11-13-21(17)16-8-6-5-7-9-16/h5-9,11,13-15H,10,12H2,1-4H3,(H,18,19)
InChIKeyJMJVPJUBYHTNJW-UHFFFAOYSA-N
XLogP3.40
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,3-dimethylbutan-2-yl)-1-phenylimidazol-2-amine
CID 106580867
2-N,2-N,2-trimethyl-1-N-(1-phenylimidazol-2-yl)propane-1,2-diamine
CID 106569028
N-[2-(2-methylpyrazol-3-yl)ethyl]-1-phenylimidazol-2-amine
CID 106583004
N-(2,2-dicyclopropylethyl)-1-phenylimidazol-2-amine
CID 106575715
N-[(1-methylcyclopentyl)methyl]-1-phenylimidazol-2-amine
CID 106572301
6-N-[2-[di(propan-2-yl)amino]ethyl]-2-N-ethyl-9-phenylpurine-2,6-diamine
CID 117091747
N-[(4-bromophenyl)methyl]-1-phenylimidazol-2-amine
CID 106560530
N-(cyclohexylmethyl)-1-phenylimidazol-2-amine
CID 106561651
N-butyl-1-[4-(dimethylamino)phenyl]imidazol-2-amine
CID 106562661
N-butyl-1-[2-[di(propan-2-yl)amino]ethyl]imidazol-2-amine
CID 106555556
N'-methyl-N'-phenyl-N-(1-propan-2-ylimidazol-2-yl)propane-1,3-diamine
CID 106556651
N-(2-methylphenyl)-1-phenylimidazol-2-amine
CID 106560579

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine?
The IUPAC name of N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine (CID 106555586) is N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine?
The canonical SMILES for N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine is CC(C)N(CCNc1nccn1-c1ccccc1)C(C)C.
What is the InChIKey of N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine?
The InChIKey is JMJVPJUBYHTNJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4/c1-14(2)20(15(3)4)12-10-18-17-19-11-13-21(17)16-8-6-5-7-9-16/h5-9,11,13-15H,10,12H2,1-4H3,(H,18,19).
What are the key properties of N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine?
N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine has a molecular weight of 286.42 g/mol, XLogP of 3.40, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylimidazol-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 106555586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).