(2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide

C20H30N4O2 — CID 164626274

IUPAC(2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide
SMILESO=C(NC1CCCCC1)[C@@]1(CCO)CC12CCN(c1ncccn1)CC2
InChIInChI=1S/C20H30N4O2/c25-14-9-20(17(26)23-16-5-2-1-3-6-16)15-19(20)7-12-24(13-8-19)18-21-10-4-11-22-18/h4,10-11,16,25H,1-3,5-9,12-15H2,(H,23,26)/t20-/m1/s1
InChIKeyCIAKFDIHOHYRCV-HXUWFJFHSA-N
MW358.49 g/mol
LogP2.28
Rot. Bonds5

About (2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide

(2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide (PubChem CID 164626274) has the molecular formula C20H30N4O2 and a molecular weight of 358.49 g/mol. Its IUPAC name is (2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide
PubChem CID164626274
Molecular FormulaC20H30N4O2
Molecular Weight358.49 g/mol
Exact Mass358.24
IUPAC Name(2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide
SMILESO=C(NC1CCCCC1)[C@@]1(CCO)CC12CCN(c1ncccn1)CC2
InChIInChI=1S/C20H30N4O2/c25-14-9-20(17(26)23-16-5-2-1-3-6-16)15-19(20)7-12-24(13-8-19)18-21-10-4-11-22-18/h4,10-11,16,25H,1-3,5-9,12-15H2,(H,23,26)/t20-/m1/s1
InChIKeyCIAKFDIHOHYRCV-HXUWFJFHSA-N
XLogP2.28
TPSA78.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-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 (2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide?
The IUPAC name of (2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide (CID 164626274) is (2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide.
What is the SMILES notation for (2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide?
The canonical SMILES for (2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide is O=C(NC1CCCCC1)[C@@]1(CCO)CC12CCN(c1ncccn1)CC2.
What is the InChIKey of (2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide?
The InChIKey is CIAKFDIHOHYRCV-HXUWFJFHSA-N. The full InChI is InChI=1S/C20H30N4O2/c25-14-9-20(17(26)23-16-5-2-1-3-6-16)15-19(20)7-12-24(13-8-19)18-21-10-4-11-22-18/h4,10-11,16,25H,1-3,5-9,12-15H2,(H,23,26)/t20-/m1/s1.
What are the key properties of (2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide?
(2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide has a molecular weight of 358.49 g/mol, XLogP of 2.28, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclohexyl-2-(2-hydroxyethyl)-6-pyrimidin-2-yl-6-azaspiro[2.5]octane-2-carboxamide is sourced from PubChem (CID 164626274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).