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

C11H20N4O — CID 80688817

IUPACN,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide
SMILESCC(NCCc1cnn(C)c1)C(=O)N(C)C
InChIInChI=1S/C11H20N4O/c1-9(11(16)14(2)3)12-6-5-10-7-13-15(4)8-10/h7-9,12H,5-6H2,1-4H3
InChIKeyNACVFNQOVAXTOC-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.03
Rot. Bonds5

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

N,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide (PubChem CID 80688817) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is N,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide
PubChem CID80688817
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC NameN,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide
SMILESCC(NCCc1cnn(C)c1)C(=O)N(C)C
InChIInChI=1S/C11H20N4O/c1-9(11(16)14(2)3)12-6-5-10-7-13-15(4)8-10/h7-9,12H,5-6H2,1-4H3
InChIKeyNACVFNQOVAXTOC-UHFFFAOYSA-N
XLogP0.03
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]butanoic acid
CID 103004675
3-[2-(1-methylpyrazol-4-yl)ethylamino]butan-2-ol
CID 80689060
2-[2-(1-methylpyrazol-4-yl)ethylamino]propan-1-ol
CID 103000884
4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-2-ol
CID 103001980
2-[2-(1-methylpyrazol-4-yl)ethylcarbamoylamino]propanoic acid
CID 80689022
N,N-dimethyl-4-[2-(1-methylpyrazol-4-yl)ethylamino]butanamide
CID 80689002
1-(1-methylpyrazol-4-yl)-5-(propan-2-ylamino)pentan-3-one
CID 103023561
4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol
CID 103947686
ethyl 2-[2-(1-methylpyrazol-4-yl)ethylamino]pentanoate
CID 83040611
N'-methyl-N'-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylethane-1,2-diamine
CID 61442014
4-chloro-N-[2-(1-methylpyrazol-4-yl)ethyl]pentan-2-amine
CID 103015314
[4-[1-[2-(1-methylpyrazol-4-yl)ethylamino]ethyl]phenyl]urea
CID 80685837

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide?
The IUPAC name of N,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide (CID 80688817) is N,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide.
What is the SMILES notation for N,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide?
The canonical SMILES for N,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide is CC(NCCc1cnn(C)c1)C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide?
The InChIKey is NACVFNQOVAXTOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-9(11(16)14(2)3)12-6-5-10-7-13-15(4)8-10/h7-9,12H,5-6H2,1-4H3.
What are the key properties of N,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide?
N,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide has a molecular weight of 224.31 g/mol, XLogP of 0.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]propanamide is sourced from PubChem (CID 80688817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).