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

C13H22N6 — CID 55046472

IUPACN,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine
SMILESCNc1c(CN(C)Cc2cnn(C)c2)c(C)nn1C
InChIInChI=1S/C13H22N6/c1-10-12(13(14-2)19(5)16-10)9-17(3)7-11-6-15-18(4)8-11/h6,8,14H,7,9H2,1-5H3
InChIKeySQTPTONGLUPBNK-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.14
Rot. Bonds5

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

N,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine (PubChem CID 55046472) has the molecular formula C13H22N6 and a molecular weight of 262.36 g/mol. Its IUPAC name is N,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine.

Molecular Properties

Compound NameN,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine
PubChem CID55046472
Molecular FormulaC13H22N6
Molecular Weight262.36 g/mol
Exact Mass262.19
IUPAC NameN,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine
SMILESCNc1c(CN(C)Cc2cnn(C)c2)c(C)nn1C
InChIInChI=1S/C13H22N6/c1-10-12(13(14-2)19(5)16-10)9-17(3)7-11-6-15-18(4)8-11/h6,8,14H,7,9H2,1-5H3
InChIKeySQTPTONGLUPBNK-UHFFFAOYSA-N
XLogP1.14
TPSA50.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[[furan-3-ylmethyl(methyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine
CID 62207198
N-methyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine
CID 62208786
N-[(2,6-dichlorophenyl)methyl]-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 22196071
N-methyl-2-[4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenyl]ethanamine
CID 105347516
4-[(cyclopropylamino)methyl]-N,1,3-trimethyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazol-5-amine
CID 61442546
1-(4-fluorophenyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]methanamine
CID 22196060
N,N-dimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]aniline
CID 75402177
[4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenyl]methanamine
CID 61438389
N'-methyl-N'-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylethane-1,2-diamine
CID 61442014
N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine
CID 105113719
N-methyl-1-[2-methyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]furan-3-yl]methanamine
CID 62463336
N-methyl-2-[4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenyl]propan-1-amine
CID 105347517

Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine?
The IUPAC name of N,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine (CID 55046472) is N,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine.
What is the SMILES notation for N,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine?
The canonical SMILES for N,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine is CNc1c(CN(C)Cc2cnn(C)c2)c(C)nn1C.
What is the InChIKey of N,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine?
The InChIKey is SQTPTONGLUPBNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N6/c1-10-12(13(14-2)19(5)16-10)9-17(3)7-11-6-15-18(4)8-11/h6,8,14H,7,9H2,1-5H3.
What are the key properties of N,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine?
N,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine has a molecular weight of 262.36 g/mol, XLogP of 1.14, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrazol-5-amine is sourced from PubChem (CID 55046472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).