6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine

C13H22N6 — CID 79300408

IUPAC6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine
SMILESCCc1nn(C)c2c1nc(N)n2CCN(C)C1CC1
InChIInChI=1S/C13H22N6/c1-4-10-11-12(18(3)16-10)19(13(14)15-11)8-7-17(2)9-5-6-9/h9H,4-8H2,1-3H3,(H2,14,15)
InChIKeyCBBROYNCRIJEDV-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.01
Rot. Bonds5

About 6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine

6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine (PubChem CID 79300408) has the molecular formula C13H22N6 and a molecular weight of 262.36 g/mol. Its IUPAC name is 6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine.

Molecular Properties

Compound Name6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine
PubChem CID79300408
Molecular FormulaC13H22N6
Molecular Weight262.36 g/mol
Exact Mass262.19
IUPAC Name6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine
SMILESCCc1nn(C)c2c1nc(N)n2CCN(C)C1CC1
InChIInChI=1S/C13H22N6/c1-4-10-11-12(18(3)16-10)19(13(14)15-11)8-7-17(2)9-5-6-9/h9H,4-8H2,1-3H3,(H2,14,15)
InChIKeyCBBROYNCRIJEDV-UHFFFAOYSA-N
XLogP1.01
TPSA64.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-Methyl-3-propyl-6-[2-(2,2,2-trifluoroethoxy)ethyl]imidazo[4,5-d]pyrazol-5-amine
CID 79282278
5-(2-Chloroethyl)-1-methyl-3-propyl-6-(3,3,3-trifluoropropyl)imidazo[4,5-d]pyrazole
CID 79283836
5-(1-Chloroethyl)-1-methyl-3-propyl-6-(3,3,3-trifluoropropyl)imidazo[4,5-d]pyrazole
CID 79284617
1,3-Dimethyl-6-(2,2,2-trifluoroethyl)imidazo[4,5-d]pyrazol-5-amine
CID 79296917
1,3-Dimethyl-6-(3,3,3-trifluoropropyl)imidazo[4,5-d]pyrazol-5-amine
CID 79297153
1-Methyl-3-propyl-6-(2,2,2-trifluoroethyl)imidazo[4,5-d]pyrazol-5-amine
CID 79299625
3-Ethyl-1-methyl-6-(2,2,2-trifluoroethyl)imidazo[4,5-d]pyrazol-5-amine
CID 79299633
5-(Chloromethyl)-3-ethyl-1-methyl-6-(2,2,2-trifluoroethyl)imidazo[4,5-d]pyrazole
CID 79299656
5-(2-Chloroethyl)-3-ethyl-1-methyl-6-(2,2,2-trifluoroethyl)imidazo[4,5-d]pyrazole
CID 79299722
3-Ethyl-1-methyl-6-[2-(2,2,2-trifluoroethoxy)ethyl]imidazo[4,5-d]pyrazol-5-amine
CID 79299851
5-(1-Chloroethyl)-3-ethyl-1-methyl-6-(3,3,3-trifluoropropyl)imidazo[4,5-d]pyrazole
CID 79300499
5-(Chloromethyl)-3-ethyl-1-methyl-6-(3,3,3-trifluoropropyl)imidazo[4,5-d]pyrazole
CID 79300569

Frequently Asked Questions

What is the IUPAC name of 6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine?
The IUPAC name of 6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine (CID 79300408) is 6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine.
What is the SMILES notation for 6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine?
The canonical SMILES for 6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine is CCc1nn(C)c2c1nc(N)n2CCN(C)C1CC1.
What is the InChIKey of 6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine?
The InChIKey is CBBROYNCRIJEDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N6/c1-4-10-11-12(18(3)16-10)19(13(14)15-11)8-7-17(2)9-5-6-9/h9H,4-8H2,1-3H3,(H2,14,15).
What are the key properties of 6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine?
6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine has a molecular weight of 262.36 g/mol, XLogP of 1.01, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine is sourced from PubChem (CID 79300408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).