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

C12H20N6 — CID 79297718

IUPAC6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine
SMILESCc1nn(C)c2c1nc(N)n2CCN(C)C1CC1
InChIInChI=1S/C12H20N6/c1-8-10-11(17(3)15-8)18(12(13)14-10)7-6-16(2)9-4-5-9/h9H,4-7H2,1-3H3,(H2,13,14)
InChIKeyKYZFEINNDDNVAT-UHFFFAOYSA-N
MW248.33 g/mol
LogP0.75
Rot. Bonds4

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

6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine (PubChem CID 79297718) has the molecular formula C12H20N6 and a molecular weight of 248.33 g/mol. Its IUPAC name is 6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine.

Molecular Properties

Compound Name6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine
PubChem CID79297718
Molecular FormulaC12H20N6
Molecular Weight248.33 g/mol
Exact Mass248.17
IUPAC Name6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine
SMILESCc1nn(C)c2c1nc(N)n2CCN(C)C1CC1
InChIInChI=1S/C12H20N6/c1-8-10-11(17(3)15-8)18(12(13)14-10)7-6-16(2)9-4-5-9/h9H,4-7H2,1-3H3,(H2,13,14)
InChIKeyKYZFEINNDDNVAT-UHFFFAOYSA-N
XLogP0.75
TPSA64.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-[2-[cyclopropyl(methyl)amino]ethyl]-3-ethyl-1-methylimidazo[4,5-d]pyrazol-5-amine
CID 79300408
1,3-dimethyl-6-(2-methylsulfanylethyl)imidazo[4,5-d]pyrazol-5-amine
CID 79296796
2-(5-amino-1,3-dimethylimidazo[4,5-d]pyrazol-6-yl)-N,N-dimethylacetamide
CID 79297215
1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine
CID 79274716
1,3-dimethyl-6-(oxolan-3-ylmethyl)imidazo[4,5-d]pyrazol-5-amine
CID 79297295
1,3-dimethyl-6-(2,3,3-trimethylbutyl)imidazo[4,5-d]pyrazol-5-amine
CID 83144563
1-[2-[cyclopropyl(methyl)amino]ethyl]-4-methylimidazol-2-amine
CID 106571517
6-N,6-N,1,3-tetramethylimidazo[4,5-d]pyrazole-5,6-diamine
CID 83019391
6-(2,2-dimethylbutyl)-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine
CID 103462891
1,3-dimethyl-6-[2-(3-methylphenyl)ethyl]imidazo[4,5-d]pyrazol-5-amine
CID 79297502
3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine
CID 79299715
N-[3-(5-amino-1,3-dimethylimidazo[4,5-d]pyrazol-6-yl)propyl]methanesulfonamide
CID 106338980

Frequently Asked Questions

What is the IUPAC name of 6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine?
The IUPAC name of 6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine (CID 79297718) is 6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine.
What is the SMILES notation for 6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine?
The canonical SMILES for 6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine is Cc1nn(C)c2c1nc(N)n2CCN(C)C1CC1.
What is the InChIKey of 6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine?
The InChIKey is KYZFEINNDDNVAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N6/c1-8-10-11(17(3)15-8)18(12(13)14-10)7-6-16(2)9-4-5-9/h9H,4-7H2,1-3H3,(H2,13,14).
What are the key properties of 6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine?
6-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine has a molecular weight of 248.33 g/mol, XLogP of 0.75, 4 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]-1,3-dimethylimidazo[4,5-d]pyrazol-5-amine is sourced from PubChem (CID 79297718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).