N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide

C15H21N5O — CID 103107422

IUPACN-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide
SMILESCCN(C)C(=O)C(C)NCc1cn[nH]c1-c1cccnc1
InChIInChI=1S/C15H21N5O/c1-4-20(3)15(21)11(2)17-9-13-10-18-19-14(13)12-6-5-7-16-8-12/h5-8,10-11,17H,4,9H2,1-3H3,(H,18,19)
InChIKeyFMZPHEBLCWWIIA-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.43
Rot. Bonds6

About N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide

N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide (PubChem CID 103107422) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide
PubChem CID103107422
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC NameN-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide
SMILESCCN(C)C(=O)C(C)NCc1cn[nH]c1-c1cccnc1
InChIInChI=1S/C15H21N5O/c1-4-20(3)15(21)11(2)17-9-13-10-18-19-14(13)12-6-5-7-16-8-12/h5-8,10-11,17H,4,9H2,1-3H3,(H,18,19)
InChIKeyFMZPHEBLCWWIIA-UHFFFAOYSA-N
XLogP1.43
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide?
The IUPAC name of N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide (CID 103107422) is N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide.
What is the SMILES notation for N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide?
The canonical SMILES for N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide is CCN(C)C(=O)C(C)NCc1cn[nH]c1-c1cccnc1.
What is the InChIKey of N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide?
The InChIKey is FMZPHEBLCWWIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-4-20(3)15(21)11(2)17-9-13-10-18-19-14(13)12-6-5-7-16-8-12/h5-8,10-11,17H,4,9H2,1-3H3,(H,18,19).
What are the key properties of N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide?
N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide has a molecular weight of 287.37 g/mol, XLogP of 1.43, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methylamino]propanamide is sourced from PubChem (CID 103107422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).