N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine

C13H21N5 — CID 62195408

IUPACN,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine
SMILESCNc1c(Cn2nc(C)c(C)c2C)c(C)nn1C
InChIInChI=1S/C13H21N5/c1-8-9(2)16-18(11(8)4)7-12-10(3)15-17(6)13(12)14-5/h14H,7H2,1-6H3
InChIKeyCSCWCYAPDYZIGS-UHFFFAOYSA-N
MW247.35 g/mol
LogP1.94
Rot. Bonds3

About N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine

N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine (PubChem CID 62195408) has the molecular formula C13H21N5 and a molecular weight of 247.35 g/mol. Its IUPAC name is N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine.

Molecular Properties

Compound NameN,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine
PubChem CID62195408
Molecular FormulaC13H21N5
Molecular Weight247.35 g/mol
Exact Mass247.18
IUPAC NameN,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine
SMILESCNc1c(Cn2nc(C)c(C)c2C)c(C)nn1C
InChIInChI=1S/C13H21N5/c1-8-9(2)16-18(11(8)4)7-12-10(3)15-17(6)13(12)14-5/h14H,7H2,1-6H3
InChIKeyCSCWCYAPDYZIGS-UHFFFAOYSA-N
XLogP1.94
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-3,4,5-trimethylpyrazole
CID 61226930
N,1,3-trimethyl-4-(methylsulfanylmethyl)pyrazol-5-amine
CID 62189145
1-[[1,3-dimethyl-5-(methylamino)pyrazol-4-yl]methyl]pyridin-2-one
CID 62208487
3-[[1,3-dimethyl-5-(methylamino)pyrazol-4-yl]methyl]-6-methylpyrimidin-4-one
CID 62193988
4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-1,3-dimethylpyrazol-5-amine
CID 55045198
2-[cyanomethyl-[[1,3-dimethyl-5-(methylamino)pyrazol-4-yl]methyl]amino]acetonitrile
CID 62182873
N,1,3-trimethyl-4-[(3-methylmorpholin-4-yl)methyl]pyrazol-5-amine
CID 62182581
N-methyl-5-(3,4,5-trimethylpyrazol-1-yl)pentan-1-amine
CID 62441748
N-methyl-2-[4-[(3,4,5-trimethylpyrazol-1-yl)methyl]phenyl]ethanamine
CID 105348623
N,1,3-trimethyl-4-(pyrimidin-2-ylsulfanylmethyl)pyrazol-5-amine
CID 62189467
[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methanol
CID 62194679
N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine
CID 60982104

Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine?
The IUPAC name of N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine (CID 62195408) is N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine.
What is the SMILES notation for N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine?
The canonical SMILES for N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine is CNc1c(Cn2nc(C)c(C)c2C)c(C)nn1C.
What is the InChIKey of N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine?
The InChIKey is CSCWCYAPDYZIGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5/c1-8-9(2)16-18(11(8)4)7-12-10(3)15-17(6)13(12)14-5/h14H,7H2,1-6H3.
What are the key properties of N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine?
N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine has a molecular weight of 247.35 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]pyrazol-5-amine is sourced from PubChem (CID 62195408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).