1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide

C16H26N4O3 — CID 155983844

IUPAC1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide
SMILESCCn1nc(C(=O)N[C@@H]2CC[C@@H](N3CCOCC3)[C@@H]2O)cc1C
InChIInChI=1S/C16H26N4O3/c1-3-20-11(2)10-13(18-20)16(22)17-12-4-5-14(15(12)21)19-6-8-23-9-7-19/h10,12,14-15,21H,3-9H2,1-2H3,(H,17,22)/t12-,14-,15-/m1/s1
InChIKeyVJDMOIWPWSISPD-BPLDGKMQSA-N
MW322.41 g/mol
LogP0.17
Rot. Bonds4

About 1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide

1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide (PubChem CID 155983844) has the molecular formula C16H26N4O3 and a molecular weight of 322.41 g/mol. Its IUPAC name is 1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide
PubChem CID155983844
Molecular FormulaC16H26N4O3
Molecular Weight322.41 g/mol
Exact Mass322.20
IUPAC Name1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide
SMILESCCn1nc(C(=O)N[C@@H]2CC[C@@H](N3CCOCC3)[C@@H]2O)cc1C
InChIInChI=1S/C16H26N4O3/c1-3-20-11(2)10-13(18-20)16(22)17-12-4-5-14(15(12)21)19-6-8-23-9-7-19/h10,12,14-15,21H,3-9H2,1-2H3,(H,17,22)/t12-,14-,15-/m1/s1
InChIKeyVJDMOIWPWSISPD-BPLDGKMQSA-N
XLogP0.17
TPSA79.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide?
The IUPAC name of 1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide (CID 155983844) is 1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide.
What is the SMILES notation for 1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide?
The canonical SMILES for 1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide is CCn1nc(C(=O)N[C@@H]2CC[C@@H](N3CCOCC3)[C@@H]2O)cc1C.
What is the InChIKey of 1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide?
The InChIKey is VJDMOIWPWSISPD-BPLDGKMQSA-N. The full InChI is InChI=1S/C16H26N4O3/c1-3-20-11(2)10-13(18-20)16(22)17-12-4-5-14(15(12)21)19-6-8-23-9-7-19/h10,12,14-15,21H,3-9H2,1-2H3,(H,17,22)/t12-,14-,15-/m1/s1.
What are the key properties of 1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide?
1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide has a molecular weight of 322.41 g/mol, XLogP of 0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclopentyl]-5-methylpyrazole-3-carboxamide is sourced from PubChem (CID 155983844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).