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

C9H16N4O — CID 43663761

IUPACN-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide
SMILESCCNC(=O)CNCc1cn[nH]c1C
InChIInChI=1S/C9H16N4O/c1-3-11-9(14)6-10-4-8-5-12-13-7(8)2/h5,10H,3-4,6H2,1-2H3,(H,11,14)(H,12,13)
InChIKeyQQAOWIPEYCZFIP-UHFFFAOYSA-N
MW196.25 g/mol
LogP-0.06
Rot. Bonds5

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

N-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide (PubChem CID 43663761) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is N-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide
PubChem CID43663761
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC NameN-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide
SMILESCCNC(=O)CNCc1cn[nH]c1C
InChIInChI=1S/C9H16N4O/c1-3-11-9(14)6-10-4-8-5-12-13-7(8)2/h5,10H,3-4,6H2,1-2H3,(H,11,14)(H,12,13)
InChIKeyQQAOWIPEYCZFIP-UHFFFAOYSA-N
XLogP-0.06
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 5-0.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetic acid
CID 43663721
2-amino-N-[2-[(5-methyl-1H-pyrazol-4-yl)methylamino]-2-oxoethyl]acetamide
CID 61021792
3-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]butanamide
CID 60767372
2-[2-[(5-methyl-1H-pyrazol-4-yl)methylamino]-2-oxoethyl]sulfanylacetic acid
CID 104569662
2,3,4,5,6-pentamethyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide
CID 61003845
2-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]pyrazol-1-yl]acetamide
CID 43695305
N,N-dimethyl-3-[(5-methyl-1H-pyrazol-4-yl)methylamino]propanamide
CID 60925704
2-[(5-methyl-1H-pyrazol-4-yl)methylamino]ethyl carbamate
CID 83210014
2-[(5-phenyl-1H-pyrazol-4-yl)methylamino]-N-propylacetamide
CID 60663784
N-[(5-methyl-1H-pyrazol-4-yl)methyl]but-2-ynamide
CID 107989822
N-[(5-methyl-1H-pyrazol-4-yl)methyl]azepane-1-carboxamide
CID 112729713
2,2-dimethyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]-4-oxobutanoic acid
CID 65302432

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide?
The IUPAC name of N-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide (CID 43663761) is N-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide.
What is the SMILES notation for N-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide?
The canonical SMILES for N-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide is CCNC(=O)CNCc1cn[nH]c1C.
What is the InChIKey of N-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide?
The InChIKey is QQAOWIPEYCZFIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-3-11-9(14)6-10-4-8-5-12-13-7(8)2/h5,10H,3-4,6H2,1-2H3,(H,11,14)(H,12,13).
What are the key properties of N-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide?
N-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide has a molecular weight of 196.25 g/mol, XLogP of -0.06, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylamino]acetamide is sourced from PubChem (CID 43663761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).