4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine

C14H28N4O — CID 82965033

IUPAC4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine
SMILESCOCCN(c1c(CC(C)N)c(C)nn1C)C(C)C
InChIInChI=1S/C14H28N4O/c1-10(2)18(7-8-19-6)14-13(9-11(3)15)12(4)16-17(14)5/h10-11H,7-9,15H2,1-6H3
InChIKeyGGRAXIPPDODJAU-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.48
Rot. Bonds7

About 4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine

4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine (PubChem CID 82965033) has the molecular formula C14H28N4O and a molecular weight of 268.40 g/mol. Its IUPAC name is 4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine.

Molecular Properties

Compound Name4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine
PubChem CID82965033
Molecular FormulaC14H28N4O
Molecular Weight268.40 g/mol
Exact Mass268.23
IUPAC Name4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine
SMILESCOCCN(c1c(CC(C)N)c(C)nn1C)C(C)C
InChIInChI=1S/C14H28N4O/c1-10(2)18(7-8-19-6)14-13(9-11(3)15)12(4)16-17(14)5/h10-11H,7-9,15H2,1-6H3
InChIKeyGGRAXIPPDODJAU-UHFFFAOYSA-N
XLogP1.48
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine?
The IUPAC name of 4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine (CID 82965033) is 4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine.
What is the SMILES notation for 4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine?
The canonical SMILES for 4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine is COCCN(c1c(CC(C)N)c(C)nn1C)C(C)C.
What is the InChIKey of 4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine?
The InChIKey is GGRAXIPPDODJAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O/c1-10(2)18(7-8-19-6)14-13(9-11(3)15)12(4)16-17(14)5/h10-11H,7-9,15H2,1-6H3.
What are the key properties of 4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine?
4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine has a molecular weight of 268.40 g/mol, XLogP of 1.48, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine is sourced from PubChem (CID 82965033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).