N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide

C13H24N4O — CID 113232717

IUPACN,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide
SMILESCCN(CC)C(=O)C(C)NCCn1cc(C)cn1
InChIInChI=1S/C13H24N4O/c1-5-16(6-2)13(18)12(4)14-7-8-17-10-11(3)9-15-17/h9-10,12,14H,5-8H2,1-4H3
InChIKeyXREKMIJDIIPTSU-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.04
Rot. Bonds7

About N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide

N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide (PubChem CID 113232717) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide.

Molecular Properties

Compound NameN,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide
PubChem CID113232717
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC NameN,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide
SMILESCCN(CC)C(=O)C(C)NCCn1cc(C)cn1
InChIInChI=1S/C13H24N4O/c1-5-16(6-2)13(18)12(4)14-7-8-17-10-11(3)9-15-17/h9-10,12,14H,5-8H2,1-4H3
InChIKeyXREKMIJDIIPTSU-UHFFFAOYSA-N
XLogP1.04
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(4-methylpyrazol-1-yl)ethylamino]-N-propan-2-ylpropanamide
CID 113232733
N-tert-butyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide
CID 113232712
2-chloro-N-[2-(4-methylpyrazol-1-yl)ethyl]propanamide
CID 103881624
N,N-diethyl-2-(2-piperidin-1-ylethylamino)propanamide
CID 54967472
4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol
CID 115972661
(2S)-1-(2,3-dihydroindol-1-yl)-2-[2-(4-methylpyrazol-1-yl)ethylamino]propan-1-one
CID 95346896
1-(1-methylcyclopropyl)-N-[2-(4-methylpyrazol-1-yl)ethyl]ethanamine
CID 115867879
2-ethyl-N-[3-(4-methylpyrazol-1-yl)propyl]butanamide
CID 19327956
N-[2-(4-methylpyrazol-1-yl)ethyl]-1-(1,3-thiazol-4-yl)ethanamine
CID 115879479
(2S)-2-hydroxy-4-[2-(4-methylpyrazol-1-yl)ethylcarbamoylamino]butanoic acid
CID 114131625
(2R)-N-[2-(1H-indol-3-yl)ethyl]-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide
CID 95607706
(1S)-1-(4-bromophenyl)-N-[2-(4-methylpyrazol-1-yl)ethyl]ethanamine
CID 97073564

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide?
The IUPAC name of N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide (CID 113232717) is N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide.
What is the SMILES notation for N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide?
The canonical SMILES for N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide is CCN(CC)C(=O)C(C)NCCn1cc(C)cn1.
What is the InChIKey of N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide?
The InChIKey is XREKMIJDIIPTSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-5-16(6-2)13(18)12(4)14-7-8-17-10-11(3)9-15-17/h9-10,12,14H,5-8H2,1-4H3.
What are the key properties of N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide?
N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide has a molecular weight of 252.36 g/mol, XLogP of 1.04, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide is sourced from PubChem (CID 113232717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).