N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide

C10H17N3O3 — CID 43533016

IUPACN,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide
SMILESCOCCN(CCOC)C(=O)c1cn[nH]c1
InChIInChI=1S/C10H17N3O3/c1-15-5-3-13(4-6-16-2)10(14)9-7-11-12-8-9/h7-8H,3-6H2,1-2H3,(H,11,12)
InChIKeyOQFYLOMTBUOANP-UHFFFAOYSA-N
MW227.26 g/mol
LogP0.14
Rot. Bonds7

About N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide

N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide (PubChem CID 43533016) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide
PubChem CID43533016
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC NameN,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide
SMILESCOCCN(CCOC)C(=O)c1cn[nH]c1
InChIInChI=1S/C10H17N3O3/c1-15-5-3-13(4-6-16-2)10(14)9-7-11-12-8-9/h7-8H,3-6H2,1-2H3,(H,11,12)
InChIKeyOQFYLOMTBUOANP-UHFFFAOYSA-N
XLogP0.14
TPSA67.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-bis[3-(dimethylamino)propyl]-1H-pyrazole-4-carboxamide
CID 60959519
N-(2-aminoethyl)-N-ethyl-1H-pyrazole-4-carboxamide
CID 63085431
N-(methoxymethyl)-1H-pyrazole-4-carboxamide
CID 154047785
N,N-bis(2-amino-2-oxoethyl)-1H-pyrazole-4-carboxamide
CID 62923169
N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-4-carboxamide
CID 102978931
N-(2-bromo-3-methoxypropyl)-N-methyl-1H-pyrazole-4-carboxamide
CID 80671538
N-[2-(methylamino)-2-oxoethyl]-N-propyl-1H-pyrazole-4-carboxamide
CID 61041491
N-ethyl-N-(2-methoxyethyl)-2H-triazole-4-carboxamide
CID 112733352
N-ethyl-N-prop-2-ynyl-1H-pyrazole-4-carboxamide
CID 78975317
N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide
CID 63701216
N-(cyclopropylmethyl)-N-ethyl-1H-pyrazole-4-carboxamide
CID 63938903
N-(2-hydroxy-4-methoxy-2-methylbutyl)-1H-pyrazole-4-carboxamide
CID 103712317

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide (CID 43533016) is N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide is COCCN(CCOC)C(=O)c1cn[nH]c1.
What is the InChIKey of N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide?
The InChIKey is OQFYLOMTBUOANP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c1-15-5-3-13(4-6-16-2)10(14)9-7-11-12-8-9/h7-8H,3-6H2,1-2H3,(H,11,12).
What are the key properties of N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide?
N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide has a molecular weight of 227.26 g/mol, XLogP of 0.14, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 43533016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).