N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine

C15H23N5 — CID 51104773

IUPACN,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine
SMILESCc1nn(C)c(N(C)C)c1CNC(C)c1cccnc1
InChIInChI=1S/C15H23N5/c1-11(13-7-6-8-16-9-13)17-10-14-12(2)18-20(5)15(14)19(3)4/h6-9,11,17H,10H2,1-5H3
InChIKeyYUUDQDLIZPPTGJ-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.04
Rot. Bonds5

About N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine

N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine (PubChem CID 51104773) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine.

Molecular Properties

Compound NameN,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine
PubChem CID51104773
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC NameN,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine
SMILESCc1nn(C)c(N(C)C)c1CNC(C)c1cccnc1
InChIInChI=1S/C15H23N5/c1-11(13-7-6-8-16-9-13)17-10-14-12(2)18-20(5)15(14)19(3)4/h6-9,11,17H,10H2,1-5H3
InChIKeyYUUDQDLIZPPTGJ-UHFFFAOYSA-N
XLogP2.04
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine?
The IUPAC name of N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine (CID 51104773) is N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine.
What is the SMILES notation for N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine?
The canonical SMILES for N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine is Cc1nn(C)c(N(C)C)c1CNC(C)c1cccnc1.
What is the InChIKey of N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine?
The InChIKey is YUUDQDLIZPPTGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-11(13-7-6-8-16-9-13)17-10-14-12(2)18-20(5)15(14)19(3)4/h6-9,11,17H,10H2,1-5H3.
What are the key properties of N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine?
N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine has a molecular weight of 273.38 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1,3-tetramethyl-4-[(1-pyridin-3-ylethylamino)methyl]pyrazol-5-amine is sourced from PubChem (CID 51104773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).