4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine

C15H24N4O — CID 63816018

IUPAC4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine
SMILESCCN(Cc1ccco1)c1c(CC(C)N)c(C)nn1C
InChIInChI=1S/C15H24N4O/c1-5-19(10-13-7-6-8-20-13)15-14(9-11(2)16)12(3)17-18(15)4/h6-8,11H,5,9-10,16H2,1-4H3
InChIKeyLZHMCGFTSOZOSD-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.24
Rot. Bonds6

About 4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine

4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine (PubChem CID 63816018) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine.

Molecular Properties

Compound Name4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine
PubChem CID63816018
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine
SMILESCCN(Cc1ccco1)c1c(CC(C)N)c(C)nn1C
InChIInChI=1S/C15H24N4O/c1-5-19(10-13-7-6-8-20-13)15-14(9-11(2)16)12(3)17-18(15)4/h6-8,11H,5,9-10,16H2,1-4H3
InChIKeyLZHMCGFTSOZOSD-UHFFFAOYSA-N
XLogP2.24
TPSA60.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.24
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-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine?
The IUPAC name of 4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine (CID 63816018) is 4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine.
What is the SMILES notation for 4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine?
The canonical SMILES for 4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine is CCN(Cc1ccco1)c1c(CC(C)N)c(C)nn1C.
What is the InChIKey of 4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine?
The InChIKey is LZHMCGFTSOZOSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-5-19(10-13-7-6-8-20-13)15-14(9-11(2)16)12(3)17-18(15)4/h6-8,11H,5,9-10,16H2,1-4H3.
What are the key properties of 4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine?
4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine has a molecular weight of 276.38 g/mol, XLogP of 2.24, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)-1,3-dimethylpyrazol-5-amine is sourced from PubChem (CID 63816018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).