1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine

C13H21N5O2 — CID 106567619

IUPAC1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine
SMILESCOCCn1cc(-n2ccnc2NC(C)COC)cn1
InChIInChI=1S/C13H21N5O2/c1-11(10-20-3)16-13-14-4-5-18(13)12-8-15-17(9-12)6-7-19-2/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,14,16)
InChIKeyRMDSRLYQOZLYLC-UHFFFAOYSA-N
MW279.34 g/mol
LogP1.16
Rot. Bonds8

About 1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine

1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine (PubChem CID 106567619) has the molecular formula C13H21N5O2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine.

Molecular Properties

Compound Name1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine
PubChem CID106567619
Molecular FormulaC13H21N5O2
Molecular Weight279.34 g/mol
Exact Mass279.17
IUPAC Name1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine
SMILESCOCCn1cc(-n2ccnc2NC(C)COC)cn1
InChIInChI=1S/C13H21N5O2/c1-11(10-20-3)16-13-14-4-5-18(13)12-8-15-17(9-12)6-7-19-2/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,14,16)
InChIKeyRMDSRLYQOZLYLC-UHFFFAOYSA-N
XLogP1.16
TPSA66.13 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-methoxyethyl)-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine
CID 106567653
N-cyclopropyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine
CID 106567651
N-cyclopentyl-1-[1-(2-methoxyethyl)pyrazol-4-yl]imidazol-2-amine
CID 106567620
1-(1,3-dimethylpyrazol-4-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106583189
N-(1-methoxypropan-2-yl)-1-naphthalen-2-ylimidazol-2-amine
CID 106565449
N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine
CID 97338513
N,1-bis(1-methoxypropan-2-yl)imidazol-2-amine
CID 106556138
1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)pyrazol-4-amine
CID 43729075
2-N-[1-(2-methoxyethyl)pyrazol-4-yl]propane-1,2-diamine
CID 103388669
N-(1-methoxypropan-2-yl)-1-(3-methylbutyl)imidazol-2-amine
CID 106557283
1-(2-ethylphenyl)-N-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106559461
N-(1-methoxypropan-2-yl)-1-[2-(2-methylpropoxy)ethyl]imidazol-2-amine
CID 106582356

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine?
The IUPAC name of 1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine (CID 106567619) is 1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine.
What is the SMILES notation for 1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine?
The canonical SMILES for 1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine is COCCn1cc(-n2ccnc2NC(C)COC)cn1.
What is the InChIKey of 1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine?
The InChIKey is RMDSRLYQOZLYLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O2/c1-11(10-20-3)16-13-14-4-5-18(13)12-8-15-17(9-12)6-7-19-2/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,14,16).
What are the key properties of 1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine?
1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine has a molecular weight of 279.34 g/mol, XLogP of 1.16, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxyethyl)pyrazol-4-yl]-N-(1-methoxypropan-2-yl)imidazol-2-amine is sourced from PubChem (CID 106567619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).