N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide

C10H13N5O2 — CID 81257970

IUPACN-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide
SMILESCOCCn1cc(NC(=O)n2ccnc2)cn1
InChIInChI=1S/C10H13N5O2/c1-17-5-4-15-7-9(6-12-15)13-10(16)14-3-2-11-8-14/h2-3,6-8H,4-5H2,1H3,(H,13,16)
InChIKeyKEVFLGVTTHDWBM-UHFFFAOYSA-N
MW235.25 g/mol
LogP0.81
Rot. Bonds4

About N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide

N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide (PubChem CID 81257970) has the molecular formula C10H13N5O2 and a molecular weight of 235.25 g/mol. Its IUPAC name is N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide.

Molecular Properties

Compound NameN-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide
PubChem CID81257970
Molecular FormulaC10H13N5O2
Molecular Weight235.25 g/mol
Exact Mass235.11
IUPAC NameN-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide
SMILESCOCCn1cc(NC(=O)n2ccnc2)cn1
InChIInChI=1S/C10H13N5O2/c1-17-5-4-15-7-9(6-12-15)13-10(16)14-3-2-11-8-14/h2-3,6-8H,4-5H2,1H3,(H,13,16)
InChIKeyKEVFLGVTTHDWBM-UHFFFAOYSA-N
XLogP0.81
TPSA73.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide
CID 81257251
N-[1-(2-methoxyethyl)pyrazol-4-yl]but-2-enamide
CID 78968035
3-chloro-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyridine-4-carboxamide
CID 66482554
(2S,6S)-N-[1-(2-methoxyethyl)pyrazol-4-yl]-2,6-dimethylmorpholine-4-carboxamide
CID 94156989
(2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride
CID 119292252
2,6-dihydroxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]benzamide
CID 103749044
2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]pentanamide;hydrochloride
CID 119292254
2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-3-methylbutanamide;hydrochloride
CID 119292257
4-amino-5-[[1-(2-methoxyethyl)pyrazol-4-yl]amino]-5-oxopentanoic acid
CID 64895222
1-ethyl-3-[1-(2-methoxyethyl)pyrazol-4-yl]thiourea
CID 115590262
2-bromo-N-[1-(2-methoxyethyl)pyrazol-4-yl]benzamide
CID 54878147
3-[[1-(2-methoxyethyl)pyrazol-4-yl]carbamoylamino]-2,2-dimethylpropanoic acid
CID 115428582

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide?
The IUPAC name of N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide (CID 81257970) is N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide.
What is the SMILES notation for N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide?
The canonical SMILES for N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide is COCCn1cc(NC(=O)n2ccnc2)cn1.
What is the InChIKey of N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide?
The InChIKey is KEVFLGVTTHDWBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2/c1-17-5-4-15-7-9(6-12-15)13-10(16)14-3-2-11-8-14/h2-3,6-8H,4-5H2,1H3,(H,13,16).
What are the key properties of N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide?
N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide has a molecular weight of 235.25 g/mol, XLogP of 0.81, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide is sourced from PubChem (CID 81257970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).