N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine

C14H23N5 — CID 105113719

IUPACN-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine
SMILESCNC(Cc1cnn(C)c1)Cc1c(C)nn(C)c1C
InChIInChI=1S/C14H23N5/c1-10-14(11(2)19(5)17-10)7-13(15-3)6-12-8-16-18(4)9-12/h8-9,13,15H,6-7H2,1-5H3
InChIKeyCUHSHRNZVYXBPZ-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.14
Rot. Bonds5

About N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine

N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine (PubChem CID 105113719) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine.

Molecular Properties

Compound NameN-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine
PubChem CID105113719
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC NameN-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine
SMILESCNC(Cc1cnn(C)c1)Cc1c(C)nn(C)c1C
InChIInChI=1S/C14H23N5/c1-10-14(11(2)19(5)17-10)7-13(15-3)6-12-8-16-18(4)9-12/h8-9,13,15H,6-7H2,1-5H3
InChIKeyCUHSHRNZVYXBPZ-UHFFFAOYSA-N
XLogP1.14
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine?
The IUPAC name of N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine (CID 105113719) is N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine.
What is the SMILES notation for N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine?
The canonical SMILES for N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine is CNC(Cc1cnn(C)c1)Cc1c(C)nn(C)c1C.
What is the InChIKey of N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine?
The InChIKey is CUHSHRNZVYXBPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-10-14(11(2)19(5)17-10)7-13(15-3)6-12-8-16-18(4)9-12/h8-9,13,15H,6-7H2,1-5H3.
What are the key properties of N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine?
N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine has a molecular weight of 261.37 g/mol, XLogP of 1.14, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine is sourced from PubChem (CID 105113719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).