4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine

C15H26N4 — CID 43569438

IUPAC4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine
SMILESCc1nn(C)c(N(C)C(C)C2CC2)c1CNC1CC1
InChIInChI=1S/C15H26N4/c1-10-14(9-16-13-7-8-13)15(19(4)17-10)18(3)11(2)12-5-6-12/h11-13,16H,5-9H2,1-4H3
InChIKeyWDJJZXOUCLFDOH-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.22
Rot. Bonds6

About 4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine

4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine (PubChem CID 43569438) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine.

Molecular Properties

Compound Name4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine
PubChem CID43569438
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine
SMILESCc1nn(C)c(N(C)C(C)C2CC2)c1CNC1CC1
InChIInChI=1S/C15H26N4/c1-10-14(9-16-13-7-8-13)15(19(4)17-10)18(3)11(2)12-5-6-12/h11-13,16H,5-9H2,1-4H3
InChIKeyWDJJZXOUCLFDOH-UHFFFAOYSA-N
XLogP2.22
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine?
The IUPAC name of 4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine (CID 43569438) is 4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine.
What is the SMILES notation for 4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine?
The canonical SMILES for 4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine is Cc1nn(C)c(N(C)C(C)C2CC2)c1CNC1CC1.
What is the InChIKey of 4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine?
The InChIKey is WDJJZXOUCLFDOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-10-14(9-16-13-7-8-13)15(19(4)17-10)18(3)11(2)12-5-6-12/h11-13,16H,5-9H2,1-4H3.
What are the key properties of 4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine?
4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine has a molecular weight of 262.40 g/mol, XLogP of 2.22, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N,1,3-trimethylpyrazol-5-amine is sourced from PubChem (CID 43569438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).