N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine

C15H26N6 — CID 51105025

IUPACN,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine
SMILESCC(C)c1nn(C)c(N(C)C)c1CNCc1ccnn1C
InChIInChI=1S/C15H26N6/c1-11(2)14-13(15(19(3)4)21(6)18-14)10-16-9-12-7-8-17-20(12)5/h7-8,11,16H,9-10H2,1-6H3
InChIKeyDLQWHTQNXCVVES-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.63
Rot. Bonds6

About N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine

N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine (PubChem CID 51105025) has the molecular formula C15H26N6 and a molecular weight of 290.41 g/mol. Its IUPAC name is N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine.

Molecular Properties

Compound NameN,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine
PubChem CID51105025
Molecular FormulaC15H26N6
Molecular Weight290.41 g/mol
Exact Mass290.22
IUPAC NameN,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine
SMILESCC(C)c1nn(C)c(N(C)C)c1CNCc1ccnn1C
InChIInChI=1S/C15H26N6/c1-11(2)14-13(15(19(3)4)21(6)18-14)10-16-9-12-7-8-17-20(12)5/h7-8,11,16H,9-10H2,1-6H3
InChIKeyDLQWHTQNXCVVES-UHFFFAOYSA-N
XLogP1.63
TPSA50.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine?
The IUPAC name of N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine (CID 51105025) is N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine.
What is the SMILES notation for N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine?
The canonical SMILES for N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine is CC(C)c1nn(C)c(N(C)C)c1CNCc1ccnn1C.
What is the InChIKey of N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine?
The InChIKey is DLQWHTQNXCVVES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N6/c1-11(2)14-13(15(19(3)4)21(6)18-14)10-16-9-12-7-8-17-20(12)5/h7-8,11,16H,9-10H2,1-6H3.
What are the key properties of N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine?
N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine has a molecular weight of 290.41 g/mol, XLogP of 1.63, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1-trimethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]-3-propan-2-ylpyrazol-5-amine is sourced from PubChem (CID 51105025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).