N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine

C11H17N5 — CID 115751678

IUPACN-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine
SMILESCc1n[nH]c(C)c1CNc1cc(C)n(C)n1
InChIInChI=1S/C11H17N5/c1-7-5-11(15-16(7)4)12-6-10-8(2)13-14-9(10)3/h5H,6H2,1-4H3,(H,12,15)(H,13,14)
InChIKeyKNOPUHNAFCDZTQ-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.68
Rot. Bonds3

About N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine

N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine (PubChem CID 115751678) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine.

Molecular Properties

Compound NameN-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine
PubChem CID115751678
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC NameN-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine
SMILESCc1n[nH]c(C)c1CNc1cc(C)n(C)n1
InChIInChI=1S/C11H17N5/c1-7-5-11(15-16(7)4)12-6-10-8(2)13-14-9(10)3/h5H,6H2,1-4H3,(H,12,15)(H,13,14)
InChIKeyKNOPUHNAFCDZTQ-UHFFFAOYSA-N
XLogP1.68
TPSA58.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2,6-dimethylphenyl)methyl]-1,5-dimethylpyrazol-3-amine
CID 113349771
1,5-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazol-3-amine
CID 19626325
3-(3,5-dimethylpyrazol-1-yl)-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]propan-1-amine
CID 86808394
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3,4-dimethylaniline
CID 43644839
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3,5,6-tetrafluoroaniline
CID 107643733
2,4,5-trichloro-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline
CID 43644783
N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine
CID 122166863
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 56902883
1,5-dimethyl-N-[(3-methyl-1-propan-2-ylpyrazol-4-yl)methyl]pyrazol-3-amine
CID 122167521
N-[(2,5-dimethylfuran-3-yl)methyl]-1,5-dimethylpyrazol-3-amine
CID 115876966
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-fluoro-5-methylaniline
CID 79054856
N-[(3-amino-4-chlorophenyl)methyl]-1,5-dimethylpyrazol-3-amine
CID 114253659

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine?
The IUPAC name of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine (CID 115751678) is N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine.
What is the SMILES notation for N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine?
The canonical SMILES for N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine is Cc1n[nH]c(C)c1CNc1cc(C)n(C)n1.
What is the InChIKey of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine?
The InChIKey is KNOPUHNAFCDZTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-7-5-11(15-16(7)4)12-6-10-8(2)13-14-9(10)3/h5H,6H2,1-4H3,(H,12,15)(H,13,14).
What are the key properties of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine?
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine has a molecular weight of 219.29 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine is sourced from PubChem (CID 115751678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).