(2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide

C13H19N5O2 — CID 126431414

IUPAC(2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide
SMILESCOCCn1cncc1CNC(=O)[C@@H](C)n1cccn1
InChIInChI=1S/C13H19N5O2/c1-11(18-5-3-4-16-18)13(19)15-9-12-8-14-10-17(12)6-7-20-2/h3-5,8,10-11H,6-7,9H2,1-2H3,(H,15,19)/t11-/m1/s1
InChIKeySADJSNRVRDZPMA-LLVKDONJSA-N
MW277.33 g/mol
LogP0.60
Rot. Bonds7

About (2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide

(2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide (PubChem CID 126431414) has the molecular formula C13H19N5O2 and a molecular weight of 277.33 g/mol. Its IUPAC name is (2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide
PubChem CID126431414
Molecular FormulaC13H19N5O2
Molecular Weight277.33 g/mol
Exact Mass277.15
IUPAC Name(2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide
SMILESCOCCn1cncc1CNC(=O)[C@@H](C)n1cccn1
InChIInChI=1S/C13H19N5O2/c1-11(18-5-3-4-16-18)13(19)15-9-12-8-14-10-17(12)6-7-20-2/h3-5,8,10-11H,6-7,9H2,1-2H3,(H,15,19)/t11-/m1/s1
InChIKeySADJSNRVRDZPMA-LLVKDONJSA-N
XLogP0.60
TPSA73.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-propan-2-ylpyrazole-3-carboxamide
CID 119066697
2-ethylsulfanyl-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]propanamide
CID 135110031
2-methoxy-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]pyridine-3-carboxamide
CID 118771778
N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]cyclopentanecarboxamide
CID 91774846
N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2,3,5,6-tetramethylbenzamide
CID 46992676
N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-(2-methylphenyl)sulfanylacetamide
CID 118788982
N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrrolidin-1-ylacetamide
CID 91777901
(2S)-2-pyrazol-1-yl-N-[(2,4,5-trimethoxyphenyl)methyl]propanamide
CID 35714023
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-pyrazol-1-ylpropanamide
CID 79524033
1-(2-methoxyethyl)-5-(2-methylpropyl)imidazole
CID 139364682
2-methoxy-N-[[3-(2-propan-2-yloxyethyl)imidazol-4-yl]methyl]ethanamine
CID 113450980
N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-(1-methyl-6-oxopyridazin-3-yl)benzamide
CID 122563016

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide?
The IUPAC name of (2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide (CID 126431414) is (2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for (2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide?
The canonical SMILES for (2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide is COCCn1cncc1CNC(=O)[C@@H](C)n1cccn1.
What is the InChIKey of (2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide?
The InChIKey is SADJSNRVRDZPMA-LLVKDONJSA-N. The full InChI is InChI=1S/C13H19N5O2/c1-11(18-5-3-4-16-18)13(19)15-9-12-8-14-10-17(12)6-7-20-2/h3-5,8,10-11H,6-7,9H2,1-2H3,(H,15,19)/t11-/m1/s1.
What are the key properties of (2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide?
(2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide has a molecular weight of 277.33 g/mol, XLogP of 0.60, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 126431414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).